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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
10-Nitrolinoleate10-Nitrolinoleic acidME546972--2.2170.5
10-Nitrooleate10-Nitrooleic acidME546973--1.86655.5
12-Aminododecanoic acid12-Aminododecanoic acidME546975--2.86950.2
"13,14-Dihydro-15-keto Prostaglandin A2"13,14-Dihydro-15-keto-PGA2ME546977--2.21772.4
Erucamide13Z-DocosenamideME547034--1.77193.5
2-Naphthylamine2-AminonaphthaleneME546986--4.04186.3
2-Aminonicotinic acid2-Aminonicotinic acidME546984--2.88479.7
4-Acetamidobutanoic acid4-Acetamidobutanoic acidME546989--5.88475.1
4-Guanidinobutyric acid4-Guanidinobutanoic acidME546990--7.56788.7
4-Piperidinecarboxamide4-Piperidine carboxamideME546991--7.50657.6
6-Ketoprostaglandin F1alpha6-Keto-PGF1alphaME546994--2.23368.4
6-Methylnicotinamide6-MethylnicotinamideME546995--7.37482.8
9-Nitrooleate9-Nitrooleic acidME546997--2.16381.3
9-Oxo-ODE9-OxoODEME546999--2.05891.2
AcetophenoneAcetophenoneME547001--5.4782.1
AcetylcholineAcetylcholineME547003--6.69590.5
AdenineAdenineME547006--4.9184.4
AdenosineAdenosineME547007--5.54891.5
L-Alanyl-L-prolineAla-ProME547041--9.38855
AlanyltyrosineAla-TyrME547008--3.73856.2
BetaineBetaineME547010--8.51186.8
CaffeineCaffeineME547014--4.47252.9
Acetyl-L-carnitineCAR 2:0ME547004--6.3692.5
DL-CarnitineCarnitineME547029--8.71995.2
CholineCholineME547016--5.54887.9
ConiineConiineME547017--3.25571.6
CreatineCreatineME547019--9.87991.4
CreatinineCreatinineME547020--5.26587.9
CytosineCytosineME547023--7.06592.7
DesthiobiotinDethiobiotinME547026--3.62650.5
AmphetamineDextroamphetamineME547009--3.16783.8
DextromethorphanDextromethorphanME547027--1.9170.2
D-(+)-ProlineD-ProlineME547025--9.23390.6
EcgonineEcgonineME547033--8.32875.6
CaprolactamEpsilon-caprolactamME547015--2.36491.6
GlycylprolineGly-ProME547036--10.32190.9
GuanineGuanineME547037--7.70792.6
HistamineHistamineME547038--4.8653.9
HypoxanthineHypoxanthineME547039--5.19194.3
alpha-LactoseLactoseME547092--11.20391.6
D-(+)-MaltoseMaltoseME547024--11.26991.5
Methylimidazoleacetic acidMethylimidazoleacetic acidME547044--9.16469.9
N6-Acetyl-L-lysineN6-AcetyllysineME547050--9.75973.5
N8-AcetylspermidineN8-AcetylspermidineME547051--10.91987
AcetylarginineN-AcetylarginineME547002--6.35877.1
N-AcetylhistamineN-AcetylhistamineME547052--7.49187
NicotinamideNiacinamideME547053--2.79691.1
N-MethylhydantoinN-MethylhydantoinME547054--2.73850.2
N-MethylnicotinamideN-MethylnicotinamideME547055--6.85676.1
L-NorleucineNorleucineME547042--8.18491.8
Palmitoyl ethanolamidePalmitoyl-EAME547059--2.71175.4
D-PanthenolPantothenolME547032--2.86592
PenbutololPenbutololME547072--2.68764.3
PEG n5Pentaethylene glycolME547068--2.67591.5
Prostaglandin B1PGB1ME547077--1.85381.3
L-PhenylalaninePhenylalanineME547043--8.19491.9
Pinolenic acidPinolenic acidME547073--1.82876.6
ProlylglycinePro-GlyME547075--9.84984.4
ProlylleucinePro-LeuME547076--6.63888.9
Palmitoyl sphingomyelinSM 18:1;O2/16:0ME547060--3.11479.9
DL-StachydrineStachydrineME547031--8.44189.7
TaurineTaurineME547079--9.53880.1
TramadolTramadolME547081--2.18577.8
TriethanolamineTriethanolamineME547084--8.02191
Urocanic acidUrocanic acidME547087--3.55392
VenlafaxineVenlafaxineME547088--2.14869.3
11-alpha-Hydroxy-17-methyltestosterone-ME546974--2.23179.2
12-Oxo phytodienoic acid-ME546976--2.65789.6
"1,3-di-o-Tolylguanidine"-ME546971--2.67791.1
"15(R),19(R)-hydroxy Prostaglandin E1"-ME546978--2.10768.9
"2,2,6,6-Tetramethyl-4-piperidinol"-ME546980--4.98892.5
"2-(3-{[3-(Tetrahydro-2H-pyran-4-ylamino)-3-oxetan...-ME546979--1.85352.9
"2,3-Dinor-8-epi-prostaglandin F2alpha"-ME546981--2.6453.5
"2,4-Bis(3-methyl-2-buten-1-yl)-6a,11a-dihydro-6H-...-ME546982--2.67458
"2,6,10-Trimethyl-2,6,10-triazaundecane"-ME546983--11.86885.3
"2-Methoxy-N-[(3S,3aS,8S,9S,9aS,9bS)-3,5a,9-trimet...-ME546985--2.52955.3
2-Phenylacetohydrazide-ME546987--6.88555.9
"3-(4-Butylphenyl)-4-(4-fluorophenyl)-1,3-oxazol-2...-ME546988--3.09154.8
"5(Z),8(Z),11(Z)-Eicosatrienoic acid ethanolamide"-ME546992--2.66762.4
"6-Hydroxy-1-(hydroxymethyl)-5-{2-[(4-methoxybenzy...-ME546993--2.09850.3
"8-Bromo-2-(3-pyridinylcarbonyl)-1,3,4,12a-tetrahy...-ME546996--1.73950.5
"9-Oxo-10(E),12(E)-octadecadienoic acid"-ME546998--1.81193.4
"9S,13R-12-Oxophytodienoic acid"-ME547000--1.84587.3
Acetyl-beta-methylcholine-ME547005--4.29174.6
alpha-Eleostearic acid-ME547091--2.18289.7
Bis(2-ethylhexyl) amine-ME547011--2.28191.1
Bis(4-ethylbenzylidene)sorbitol-ME547012--1.87285.6
Cafestol-ME547013--1.7966.4
Coumatetralyl-ME547018--4.83858.4
CUDA-ME547021--2.83559.3
Cyclo(leucylprolyl)-ME547022--3.79363.3
Didecyldimethylammonium-ME547028--2.23290.2
DL-Metanephrine-ME547030--2.53865.9
Ethyl palmitoleate-ME547035--1.8377.1
Irgafos 168-ME547040--1.69484.5
"N-{4-[(2R,3R)-3-(Hydroxymethyl)-4-isobutyl-5-oxo-...-ME547048--1.83462.8
"N-{4-[(2R,3R)-3-(Hydroxymethyl)-5-oxo-2-morpholin...-ME547049--2.27152.7
"N,N-Diethylethanolamine"-ME547045--4.45858.9
"N,N-Diisopropylethylamine (DIPEA)"-ME547046--3.00588.3
"N,N'-Diphenylguanidine"-ME547047--2.78889.9
Nootkatone-ME547056--2.6568
Norbutorphanol-ME547057--2.08566
N-Phenylacetylglutamine-ME547058--3.55592.1
PEG n10-ME547061--2.67482.4
PEG n11-ME547062--2.67880.8
PEG n12-ME547063--2.68287.9
PEG n13-ME547064--2.68685.7
PEG n14-ME547065--2.6984.1
PEG n15-ME547066--2.69580.7
PEG n16-ME547067--2.71476.8
PEG n6-ME547069--2.66989.3
PEG n7-ME547070--2.67451.1
PEG n8-ME547071--2.67458.6
Prolinamide-ME547074--7.73586.6
Sedanolide-ME547078--2.2269.5
Tetrakis(2-hydroxypropyl)ethylenediamine-ME547080--3.91492.3
Tramadol N-Oxide-ME547082--2.77863.7
Tribufos-ME547083--4.03760.4
Triethylene glycol monobutyl ether-ME547085--1.99786.1
Trimethoprim impurity C-ME547086--9.953.1
Victoria Pure Blue BO-ME547089--2.24987.8
Zolazepam-ME547090--10.76953.1


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
10-Hydroxydecanoic acid10-Hydroxydecanoic acidME547178--3.68986.9
10-Nitrolinoleate10-Nitrolinoleic acidME547177--2.60982.1
11-Dehydro thromboxane B211-Dehydro-TXB2ME547173--1.69769.6
"11(Z),14(Z)-Eicosadienoic acid"11Z,14Z-Eicosadienoic acidME547176--263.4
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME547172--2.92580.4
12-Oxo leukotriene B412-Oxo-LTB4ME547171--2.6384.6
13(S)-HpOTrE13S-HpOTrEME547170--2.5573.9
15-OxoEDE15-oxoEDEME547167--2.55775
"2,3-Dinor prostaglandin E1"2,3-Dinor-PGE1ME547164--2.96372.1
3-Hydroxybutyric acid3-Hydroxybutyric acidME547161--7.69793.1
3-Hydroxydecanoic acid3-Hydroxydecanoic acidME547160--2.66188.4
4-Dodecylbenzenesulfonic acid4-Dodecylbenzenesulfonic acidME547158--1.72796.6
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME547157--3.48195.9
4-Oxoproline4-Oxo-prolineME547156--9.17892.4
7-Methylxanthine7-MethylxanthineME547152--1.74262.7
"8(S)-Hydroxy-(5Z,9E,11Z,14Z)-eicosatetraenoic aci...8S-HETEME547151--2.55284.1
AcamprosateAcamprosateME547148--2.48888.4
AdenineAdenineME547147--4.30885.4
Adrenic acidAdrenic acidME547146--1.97882.5
Arachidonic acidArachidonic acidME547145--2.0292.4
Azelaic acidAzelaic acidME547144--9.84894.5
Dodecyl sulfateBlasticidin SME547133--1.69795.7
11(Z)-Eicosenoic acidcis-Gondoic acidME547175--1.98765.4
Dibutyl phthalateDibutyl phthalateME547138--2.0456.5
Docosahexaenoic acidDocosahexaenoic acidME547135--1.98377.2
Dodecanedioic acidDodecanedioic acidME547134--3.0563.9
D-(+)-GalactoseGalactoseME547139--10.85674.2
Hexadecanedioic acidHexadecanedioic acidME547132--3.28979.5
Hydrocinnamic acidHydrocinnamic acidME547131--3.24387.2
HypoxanthineHypoxanthineME547130--5.09495.9
3-Indoxyl sulphateIndoxyl sulfateME547159--1.95393.3
N-IsovalerylglycineIsovalerylglycineME547118--3.26574.5
16-Hydroxyhexadecanoic acidJuniperic acidME547166--2.60989.2
Kynurenic acidKynurenic acidME547129--5.13685.4
alpha-LactoseLactoseME547093--10.93387.5
L-(-)-ArabitolL-ArabitolME547128--8.04290.2
Linoleic acidLinoleic acidME547126--2.01892.5
D-(-)-MannitolMannitolME547140--9.41189.1
Methylmalonic acidMethylmalonic acidME547125--10.64176.4
Monobutyl phthalateMonobutylphthalateME547123--2.58883.7
Mono(2-ethylhexyl) phthalate (MEHP)Monoethylhexyl phthalic acidME547124--2.38784.9
Myristic acidMyristic acidME547122--2.43190.7
NeopterinNeopterinME547119--1.78858.9
Oleic acidOleic acidME547117--2.04386.1
OstruthinOstruthinME547116--1.76658.7
Palmitic acidPalmitic acidME547115--2.06992.7
Palmitoleic acidPalmitoleic acidME547114--2.12487.9
PanthenolPantothenolME547113--2.75286.6
Perfluoroheptanoic acidPerfluoroheptanoic acidME547112--1.66792.9
Perfluorohexanoic acidPerfluorohexanoic acidME547111--1.69188.4
Phenylacetic acidPhenylacetic acidME547108--3.72581.4
SaccharinSaccharinME547107--2.18795.7
Salicylic acidSalicylic acidME547106--2.40697
Stearic acidStearic acidME547105--1.99799.1
SucroseSucroseME547104--10.93793.3
TaurineTaurineME547103--8.99387
Tetradecanedioic acidTetradecanedioic acidME547102--2.97850.1
Tetranor-12R-HETETetranor-12R-HETEME547101--2.60253.8
UracilUracilME547098--3.19897
Uric acidUric acidME547097--9.83692.2
Urocanic acidUrocanic acidME547096--5.66295.7
XanthineXanthineME547095--7.84883.5
10-HDA-ME547179--2.62567.1
"11,12-Epoxy-(5Z,8Z,11Z)-icosatrienoic acid"-ME547174--2.14287.1
"13,14-dihydro-15-keto-tetranor Prostaglandin D2"-ME547168--1.67956.2
"13,14-dihydro Prostaglandin F1alpha"-ME547169--2.98481.5
1-(Carboxymethyl)cyclohexanecarboxylic acid-ME547180--2.62477
"1-Methyl-3,6-(1H,2H)-pyridazinedione"-ME547165--2.85980.4
2-Naphthalenesulfonic acid-ME547163--2.29497.7
"3-[(2-Chloro-6-fluoroanilino)methylidene]pentane-...-ME547162--1.5258.8
4-Phenolsulfonic acid-ME547155--1.80589.5
"5-[(3Z)-5-Hydroxy-3-methyl-3-penten-1-yl]-1,4a-di...-ME547154--1.77572.7
5-Nitroindoline-ME547153--2.48669
"8-iso-13,14-dihydro-15-keto Prostaglandin F2alpha...-ME547150--3.07683.3
8-Iso-15-keto-prostaglandin-F2beta-ME547149--1.95670.1
alpha-Eleostearic acid-ME547094--2.06976.4
CAPSO-ME547143--1.91375.8
Corchorifatty acid F-ME547142--2.90282
"CP 47,497-C8-Homolog C-8-hydroxy metabolite"-ME547141--2.45667
DL-beta-Leucine-ME547136--7.33272.8
DL-Mandelic acid-ME547137--3.31487
Labdanolic acid-ME547127--2.52576.7
Myristyl sulfate-ME547121--1.67496.2
N-Acetyl-4-aminosalicylic acid-ME547120--3.41453.2
Perfluorononanoic acid (PFNA)-ME547110--1.63492
Perfluorooctanoic acid (PFOA)-ME547109--1.64895.8
trans-10-Heptadecenoic acid-ME547100--2.06664.8
trans-Petroselinic acid-ME547099--2.01283.9


Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
AcCa(16:0)+HCAR 16:0ME547181---400.3421355
AcCa(16:1)+HCAR 16:1ME547182---398.3264855
AcCa(18:0)+HCAR 18:0ME547183---428.3734355
AcCa(18:1)+HCAR 18:1ME547184---426.3577855
AcCa(18:2)+HCAR 18:2ME547185---424.3421355
AcCa(20:1)+HCAR 20:1ME547186---454.3890855
ChE(16:0)+NH4CE 16:0ME547354---642.6183555
ChE(16:1)+NH4CE 16:1ME547355---640.6027055
ChE(16:2)+HCE 16:2ME547356---621.5605065
ChE(18:1)+NH4CE 18:1ME547357---668.6340055
ChE(18:2)+HCE 18:2ME547358---649.5918065
ChE(18:3)+HCE 18:3ME547359---647.5761565
ChE(18:3)+NH4CE 18:3ME547360---664.6027055
ChE(20:2)+NH4CE 20:2ME547361---694.6496555
ChE(20:3)+NH4CE 20:3ME547362---692.6340055
ChE(20:4)+HCE 20:4ME547363---673.5918065
ChE(20:4)+NH4CE 20:4ME547364---690.6183555
ChE(20:5)+HCE 20:5ME547365---671.5761565
Cer(d14:0_18:1)+HCer 14:0;O2/18:1ME547187---510.4880705
Cer(d14:1_22:1)+HCer 14:1;O2/22:1ME547188---564.5350205
Cer(d14:2_18:0+O)+HCer 14:2;O2/18:0;OME547189---524.4673355
Cer(d14:2_18:1+2O)+HCer 14:2;O2/18:1;O2ME547190---538.4466005
Cer(d16:0_24:0)+NaCer 16:0;O2/24:0ME547191---646.6108655
Cer(d16:1_16:0)+HCer 16:1;O2/16:0ME547192---510.4880705
Cer(t16:1_18:1)+NaCer 16:1;O3/18:1ME547306---574.4805805
Cer(d17:0_15:0+O)+HCer 17:0;O2/15:0;OME547193---528.4986355
Cer(d17:0_16:0+O)+HCer 17:0;O2/16:0;OME547194---542.5142855
Cer(t17:0_16:0)+H-H2OCer 17:0;O3/16:0ME547307---524.5037205
Cer(t17:0_25:0+O)+HCer 17:0;O3/25:0;OME547308---684.6500505
Cer(t17:0_26:0+O)+HCer 17:0;O3/26:0;OME547309---698.6657005
Cer(d17:1_14:0)+HCer 17:1;O2/14:0ME547195---496.4724205
Cer(d17:1_16:0)+HCer 17:1;O2/16:0ME547196---524.5037205
Cer(d17:1_16:1)+HCer 17:1;O2/16:1ME547197---522.4880705
Cer(m17:1_24:1)+HCer 17:1;O/24:1ME547291---618.6183555
Cer(t17:1_24:0)+H-H2OCer 17:1;O3/24:0ME547310---634.6132705
Cer(t17:1_24:1)+H-H2OCer 17:1;O3/24:1ME547311---632.5976205
Cer(m18:0_16:0)+HCer 18:0;O/16:0ME547292---524.5401055
Cer(m18:0_18:2+O)+HCer 18:0;O/18:2;OME547293---564.5350205
Cer(d18:0_14:0)+HCer 18:0;O2/14:0ME547198---512.5037205
Cer(d18:0_16:0)+HCer 18:0;O2/16:0ME547199---540.5350205
Cer(d18:0_16:0+O)+HCer 18:0;O2/16:0;OME547200---556.5299355
Cer(d18:0_17:0)+HCer 18:0;O2/17:0ME547201---554.5506705
Cer(d18:0_17:0+O)+HCer 18:0;O2/17:0;OME547202---570.5455855
Cer(d18:0_18:0)+HCer 18:0;O2/18:0ME547203---568.5663205
Cer(d18:0_18:2)+HCer 18:0;O2/18:2ME547204---564.5350205
Cer(m18:0_22:0)+HCer 18:0;O/22:0ME547294---608.6340055
Cer(d18:0_20:0)+HCer 18:0;O2/20:0ME547205---596.5976205
Cer(d18:0_22:0)+HCer 18:0;O2/22:0ME547206---624.6289205
Cer(d18:0_23:0)+HCer 18:0;O2/23:0ME547207---638.6445705
Cer(d18:0_24:0)+HCer 18:0;O2/24:0ME547208---652.6602205
Cer(d18:0_24:0+O)+HCer 18:0;O2/24:0;OME547209---668.6551355
Cer(d18:0_24:1)+HCer 18:0;O2/24:1ME547210---650.6445705
Cer(d18:0_26:1)+HCer 18:0;O2/26:1ME547211---678.6758705
Cer(m18:0_24:0)+HCer 18:0;O/24:0ME547295---636.6653055
Cer(m18:0_24:1)+HCer 18:0;O/24:1ME547296---634.6496555
Cer(t18:0_14:0)+HCer 18:0;O3/14:0ME547312---528.4986355
Cer(t18:0_14:0+O)+HCer 18:0;O3/14:0;OME547313---544.4935505
Cer(t18:0_16:0)+HCer 18:0;O3/16:0ME547314---556.5299355
Cer(t18:0_16:0)+H-H2OCer 18:0;O3/16:0ME547315---538.5193705
Cer(t18:0_16:0+O)+H-H2OCer 18:0;O3/16:0ME547317---554.5142855
Cer(t18:0_16:0+O)+HCer 18:0;O3/16:0;OME547316---572.5248505
Cer(t18:0_16:1)+H-H2OCer 18:0;O3/16:1ME547318---536.5037205
Cer(t18:0_17:0)+H-H2OCer 18:0;O3/17:0ME547319---552.5350205
Cer(t18:0_18:0)+HCer 18:0;O3/18:0ME547320---584.5612355
Cer(t18:0_18:0+O)+H-H2OCer 18:0;O3/18:0ME547321---582.5455855
Cer(t18:0_18:1)+H-H2OCer 18:0;O3/18:1ME547322---564.5350205
Cer(t18:0_18:2)+H-H2OCer 18:0;O3/18:2ME547323---562.5193705
Cer(t18:0_18:2+2O)+HCer 18:0;O3/18:2;O2ME547324---612.5197655
Cer(t18:0_20:0+O)+HCer 18:0;O3/20:0;OME547325---628.5874505
Cer(t18:0_20:1)+H-H2OCer 18:0;O3/20:1ME547326---592.5663205
Cer(t18:0_20:1+O)+H-H2OCer 18:0;O3/20:1ME547327---608.5612355
Cer(t18:0_21:0+O)+HCer 18:0;O3/21:0;OME547328---642.6031005
Cer(t18:0_22:0)+HCer 18:0;O3/22:0ME547329---640.6238355
Cer(t18:0_22:0)+H-H2OCer 18:0;O3/22:0ME547330---622.6132705
Cer(t18:0_22:0+O)+HCer 18:0;O3/22:0;OME547331---656.6187505
Cer(t18:0_23:0)+HCer 18:0;O3/23:0ME547332---654.6394855
Cer(t18:0_23:0)+H-H2OCer 18:0;O3/23:0ME547333---636.6289205
Cer(t18:0_23:0+O)+HCer 18:0;O3/23:0;OME547334---670.6344005
Cer(t18:0_24:0)+HCer 18:0;O3/24:0ME547335---668.6551355
Cer(t18:0_24:0)+H-H2OCer 18:0;O3/24:0ME547336---650.6445705
Cer(t18:0_24:0+O)+HCer 18:0;O3/24:0;OME547337---684.6500505
Cer(t18:0_24:1)+H-H2OCer 18:0;O3/24:1ME547338---648.6289205
Cer(t18:0_24:2)+H-H2OCer 18:0;O3/24:2ME547339---646.6132705
Cer(t18:0_25:0)+HCer 18:0;O3/25:0ME547340---682.6707855
Cer(t18:0_25:0+O)+HCer 18:0;O3/25:0;OME547341---698.6657005
Cer(m18:1_18:0)+HCer 18:1;O/18:0ME547297---550.5557555
Cer(m18:1_18:0+O)+HCer 18:1;O/18:0;OME547298---566.5506705
Cer(m18:1_18:2+O)+HCer 18:1;O/18:2;OME547299---562.5193705
Cer(m18:1_20:0)+HCer 18:1;O/20:0ME547300---578.5870555
Cer(d18:1_16:0)+HCer 18:1;O2/16:0ME547212---538.5193705
Cer(d18:1_16:0+O)+HCer 18:1;O2/16:0;OME547213---554.5142855
Cer(d18:1_16:1)+HCer 18:1;O2/16:1ME547214---536.5037205
Cer(d18:1_17:0)+HCer 18:1;O2/17:0ME547215---552.5350205
Cer(d18:1_17:0+O)+HCer 18:1;O2/17:0;OME547216---568.5299355
Cer(d18:1_18:0)+HCer 18:1;O2/18:0ME547217---566.5506705
Cer(d18:1_18:0+O)+HCer 18:1;O2/18:0;OME547218---582.5455855
Cer(d18:1_18:1)+HCer 18:1;O2/18:1ME547219---564.5350205
Cer(d18:1_18:1+O)+HCer 18:1;O2/18:1;OME547221---580.5299355
Cer(d18:1_18:1+2O)+HCer 18:1;O2/18:1;O2ME547220---596.5248505
Cer(d18:1_18:2)+HCer 18:1;O2/18:2ME547222---562.5193705
Cer(d18:1_18:2+2O)+HCer 18:1;O2/18:2;O2ME547223---594.5092005
Cer(m18:1_22:0)+HCer 18:1;O/22:0ME547301---606.6183555
Cer(d18:1_20:0)+HCer 18:1;O2/20:0ME547224---594.5819705
Cer(d18:1_20:0+O)+HCer 18:1;O2/20:0;OME547225---610.5768855
Cer(d18:1_20:1)+HCer 18:1;O2/20:1ME547226---592.5663205
Cer(m18:1_22:0+O)+HCer 18:1;O/22:0;OME547302---622.6132705
Cer(d18:1_22:0)+HCer 18:1;O2/22:0ME547227---622.6132705
Cer(d18:1_22:0+O)+HCer 18:1;O2/22:0;OME547228---638.6081855
Cer(d18:1_23:0)+HCer 18:1;O2/23:0ME547229---636.6289205
Cer(d18:1_23:0+O)+HCer 18:1;O2/23:0;OME547230---652.6238355
Cer(d18:1_24:0)+HCer 18:1;O2/24:0ME547231---650.6445705
Cer(d18:1_24:0+O)+HCer 18:1;O2/24:0;OME547232---666.6394855
Cer(d18:1_24:1)+HCer 18:1;O2/24:1ME547233---648.6289205
Cer(d18:1_24:2)+HCer 18:1;O2/24:2ME547234---646.6132705
Cer(d18:1_24:3)+HCer 18:1;O2/24:3ME547235---644.5976205
Cer(d18:1_25:0)+HCer 18:1;O2/25:0ME547236---664.6602205
Cer(d18:1_26:0+O)+HCer 18:1;O2/26:0;OME547237---694.6707855
Cer(d18:1_26:1)+HCer 18:1;O2/26:1ME547238---676.6602205
Cer(d18:1_26:2)+HCer 18:1;O2/26:2ME547239---674.6445705
Cer(m18:1_23:0)+HCer 18:1;O/23:0ME547303---620.6340055
Cer(m18:1_24:1)+HCer 18:1;O/24:1ME547304---632.6340055
Cer(m18:1_26:0+O)+HCer 18:1;O/26:0;OME547305---678.6758705
Cer(t18:1_16:0)+H-H2OCer 18:1;O3/16:0ME547342---536.5037205
Cer(t18:1_18:1)+HCer 18:1;O3/18:1ME547343---580.5299355
Cer(t18:1_22:0)+H-H2OCer 18:1;O3/22:0ME547344---620.5976205
Cer(t18:1_22:0+O)+HCer 18:1;O3/22:0;OME547345---654.6031005
Cer(t18:1_23:0)+H-H2OCer 18:1;O3/23:0ME547346---634.6132705
Cer(t18:1_23:0+O)+HCer 18:1;O3/23:0;OME547347---668.6187505
Cer(t18:1_24:0+O)+HCer 18:1;O3/24:0;OME547348---682.6344005
Cer(d18:2_14:0)+HCer 18:2;O2/14:0ME547240---508.4724205
Cer(d18:2_14:0+O)+HCer 18:2;O2/14:0;OME547241---524.4673355
Cer(d18:2_16:0)+HCer 18:2;O2/16:0ME547242---536.5037205
Cer(d18:2_16:0+O)+HCer 18:2;O2/16:0;OME547243---552.4986355
Cer(d18:2_17:0)+HCer 18:2;O2/17:0ME547244---550.5193705
Cer(d18:2_18:2)+HCer 18:2;O2/18:2ME547245---560.5037205
Cer(d18:2_20:0)+HCer 18:2;O2/20:0ME547246---592.5663205
Cer(d18:2_22:0)+HCer 18:2;O2/22:0ME547247---620.5976205
Cer(d18:2_22:1)+HCer 18:2;O2/22:1ME547248---618.5819705
Cer(d18:2_23:0)+HCer 18:2;O2/23:0ME547249---634.6132705
Cer(d18:2_23:1)+HCer 18:2;O2/23:1ME547250---632.5976205
Cer(d18:2_24:0+O)+HCer 18:2;O2/24:0;OME547251---664.6238355
Cer(d18:2_24:1)+HCer 18:2;O2/24:1ME547252---646.6132705
Cer(d18:2_24:2)+HCer 18:2;O2/24:2ME547253---644.5976205
Cer(d18:2_26:0+O)+HCer 18:2;O2/26:0;OME547254---692.6551355
Cer(d19:0_17:0+O)+HCer 19:0;O2/17:0;OME547255---584.5612355
Cer(d19:0_24:0)+HCer 19:0;O2/24:0ME547256---666.6758705
Cer(d19:1_18:0)+HCer 19:1;O2/18:0ME547257---580.5663205
Cer(d19:1_18:1)+HCer 19:1;O2/18:1ME547258---578.5506705
Cer(d19:1_20:0)+HCer 19:1;O2/20:0ME547259---608.5976205
Cer(d19:1_23:3)+HCer 19:1;O2/23:3ME547260---644.5976205
Cer(d19:1_24:1)+HCer 19:1;O2/24:1ME547261---662.6445705
Cer(d19:1_24:2)+HCer 19:1;O2/24:2ME547262---660.6289205
Cer(d19:2_13:0)+HCer 19:2;O2/13:0ME547263---508.4724205
Cer(d19:2_14:0+O)+HCer 19:2;O2/14:0;OME547264---538.4829855
Cer(d19:2_16:0+O)+HCer 19:2;O2/16:0;OME547265---566.5142855
Cer(d19:2_23:0+O)+HCer 19:2;O2/23:0;OME547266---664.6238355
Cer(d19:2_26:6)+HCer 19:2;O2/26:6ME547267---678.5819705
Cer(d20:0_24:0)+HCer 20:0;O2/24:0ME547268---680.6915205
Cer(d20:0_24:0+O)+HCer 20:0;O2/24:0;OME547269---696.6864355
Cer(t20:0_24:0)+HCer 20:0;O3/24:0ME547349---696.6864355
Cer(t20:0_24:0+O)+HCer 20:0;O3/24:0;OME547350---712.6813505
Cer(t20:0_25:0+O)+HCer 20:0;O3/25:0;OME547351---726.6970005
Cer(t20:0_26:0)+HCer 20:0;O3/26:0ME547352---724.7177355
Cer(t20:0_26:0+O)+HCer 20:0;O3/26:0;OME547353---740.7126505
Cer(d20:1_17:0+O)+HCer 20:1;O2/17:0;OME547270---596.5612355
Cer(d20:1_24:0)+HCer 20:1;O2/24:0ME547271---678.6758705
Cer(d20:1_25:0)+HCer 20:1;O2/25:0ME547272---692.6915205
Cer(d22:0_24:0+O)+HCer 22:0;O2/24:0;OME547273---724.7177355
Cer(d22:0_25:0)+HCer 22:0;O2/25:0ME547274---722.7384705
Cer(d22:0_25:0+O)+HCer 22:0;O2/25:0;OME547275---738.7333855
Cer(d22:0_26:0+O)+HCer 22:0;O2/26:0;OME547276---752.7490355
Cer(d22:1_16:0)+HCer 22:1;O2/16:0ME547277---594.5819705
Cer(d22:1_25:0+O)+HCer 22:1;O2/25:0;OME547278---736.7177355
Cer(d23:0_18:0)+HCer 23:0;O2/18:0ME547279---638.6445705
Cer(d23:0_22:0)+HCer 23:0;O2/22:0ME547280---694.7071705
Cer(d23:1_16:0+O)+HCer 23:1;O2/16:0;OME547281---624.5925355
Cer(d23:1_26:0)+HCer 23:1;O2/26:0ME547282---748.7541205
Cer(d23:2_18:1)+HCer 23:2;O2/18:1ME547283---632.5976205
Cer(d23:2_18:1+O)+HCer 23:2;O2/18:1;OME547284---648.5925355
Cer(d24:0_24:0)+HCer 24:0;O2/24:0ME547285---736.7541205
Cer(d24:0_25:0)+HCer 24:0;O2/25:0ME547286---750.7697705
Cer(d24:0_25:0+O)+HCer 24:0;O2/25:0;OME547287---766.7646855
Cer(d24:0_26:0)+HCer 24:0;O2/26:0ME547288---764.7854205
Cer(d24:0_26:0+O)+HCer 24:0;O2/26:0;OME547289---780.7803355
Cer(d24:1_26:0)+HCer 24:1;O2/26:0ME547290---762.7697705
Co(Q10)+NH4Coenzyme Q10ME547366---880.7177355
Co(Q8)+NH4Coenzyme Q8ME547367---744.5925355
Co(Q9)+HCoenzyme Q9ME547368---795.6285865
Co(Q9)+NH4Coenzyme Q9ME547369---812.6551355
DG(18:2_11:1)+NH4DG 11:1_18:2ME547395---538.4466005
DG(14:0_18:3)+HDG 14:0_18:3ME547370---563.4670015
DG(14:0_18:3)+NH4DG 14:0_18:3ME547371---580.4935505
DG(16:0_16:0)+NH4DG 16:0_16:0ME547372---586.5405005
DG(16:0_16:1)+NH4DG 16:0_16:1ME547373---584.5248505
DG(16:0_18:1)+HDG 16:0_18:1ME547374---595.5296015
DG(16:0_18:1)+NH4DG 16:0_18:1ME547375---612.5561505
DG(16:0_18:3)+HDG 16:0_18:3ME547376---591.4983015
DG(16:0_18:3)+NH4DG 16:0_18:3ME547377---608.5248505
DG(16:0_22:4)+NH4DG 16:0_22:4ME547378---662.5718005
DG(16:1_16:1)+NH4DG 16:1_16:1ME547379---582.5092005
DG(16:1_18:1)+NH4DG 16:1_18:1ME547380---610.5405005
DG(16:1_18:2)+NH4DG 16:1_18:2ME547381---608.5248505
DG(16:1_18:3)+HDG 16:1_18:3ME547382---589.4826515
DG(16:1_18:3)+NH4DG 16:1_18:3ME547383---606.5092005
DG(18:0_18:1)+NH4DG 18:0_18:1ME547384---640.5874505
DG(18:0_20:4)+NH4DG 18:0_20:4ME547385---662.5718005
DG(18:1_18:1)+NH4DG 18:1_18:1ME547386---638.5718005
DG(18:1_18:2)+HDG 18:1_18:2ME547387---619.5296015
DG(18:1_18:2)+NH4DG 18:1_18:2ME547388---636.5561505
DG(18:1_18:3)+HDG 18:1_18:3ME547389---617.5139515
DG(18:1_20:2)+NH4DG 18:1_20:2ME547390---664.5874505
DG(18:1_20:4)+NH4DG 18:1_20:4ME547391---660.5561505
DG(18:1_22:4)+NH4DG 18:1_22:4ME547392---688.5874505
DG(18:1_22:5)+NH4DG 18:1_22:5ME547393---686.5718005
DG(18:1_22:6)+NH4DG 18:1_22:6ME547394---684.5561505
DG(18:2_18:2)+HDG 18:2_18:2ME547396---617.5139515
DG(18:2_18:2)+NaDG 18:2_18:2ME547397---639.4958965
DG(18:2_18:2)+NH4DG 18:2_18:2ME547398---634.5405005
DG(18:3_18:2)+NH4DG 18:2_18:3ME547399---632.5248505
DG(6:0_18:2)+NH4DG 6:0_18:2ME547401---470.3840005
DG(25:1_6:0)+NaDG 6:0_25:1ME547400---575.4645965
Hex2Cer(d18:0_24:0)+HHex2Cer 18:0;O2/24:0ME547441---976.7658705
Hex2Cer(d18:1_16:0)+HHex2Cer 18:1;O2/16:0ME547442---862.6250205
Hex2Cer(d18:1_18:0)+HHex2Cer 18:1;O2/18:0ME547443---890.6563205
Hex2Cer(d18:1_20:0)+HHex2Cer 18:1;O2/20:0ME547444---918.6876205
Hex2Cer(d18:1_22:0)+HHex2Cer 18:1;O2/22:0ME547445---946.7189205
Hex2Cer(d18:1_23:0)+HHex2Cer 18:1;O2/23:0ME547446---960.7345705
Hex2Cer(d18:1_24:0)+HHex2Cer 18:1;O2/24:0ME547447---974.7502205
Hex2Cer(d18:1_24:1)+HHex2Cer 18:1;O2/24:1ME547448---972.7345705
Hex2Cer(d18:1_24:2)+HHex2Cer 18:1;O2/24:2ME547449---970.7189205
Hex2Cer(d19:0_17:0)+HHex2Cer 19:0;O2/17:0ME547450---892.6719705
Hex3Cer(d18:1_16:0)+HHex3Cer 18:1;O2/16:0ME547451---1024.677845
Hex3Cer(d18:1_22:0)+HHex3Cer 18:1;O2/22:0ME547452---1108.771745
Hex3Cer(d18:1_24:0)+HHex3Cer 18:1;O2/24:0ME547453---1136.803045
Hex1Cer(d16:1_23:0)+HHexCer 16:1;O2/23:0ME547402---770.6504455
Hex1Cer(t17:0_24:0+O)+HHexCer 17:0;O3/24:0;O*ME547436---832.6872255
Hex1Cer(t17:0_25:0+O)+HHexCer 17:0;O3/25:0;O*ME547437---846.7028755
Hex1Cer(t17:0_26:0+O)+HHexCer 17:0;O3/26:0;O*ME547438---860.7185255
Hex1Cer(m18:0_18:2)+NH4HexCer 18:0;O/18:2ME547433---727.6194795
Hex1Cer(d18:0_22:0+O)+HHexCer 18:0;O2/22:0;OME547403---802.6766605
Hex1Cer(t18:0_22:1)+H-H2OHexCer 18:0;O3/22:1ME547439---782.6504455
Hex1Cer(t18:0_24:1)+H-H2OHexCer 18:0;O3/24:1ME547440---810.6817455
Hex1Cer(d18:1_20:0)+HHexCer 18:1;O2/20:0ME547404---756.6347955
Hex1Cer(d18:1_22:0)+HHexCer 18:1;O2/22:0ME547405---784.6660955
Hex1Cer(d18:1_22:0+O)+HHexCer 18:1;O2/22:0;OME547406---800.6610105
Hex1Cer(d18:1_22:1)+HHexCer 18:1;O2/22:1ME547407---782.6504455
Hex1Cer(d18:1_23:0)+HHexCer 18:1;O2/23:0ME547408---798.6817455
Hex1Cer(d18:1_23:0+O)+HHexCer 18:1;O2/23:0;OME547409---814.6766605
Hex1Cer(d18:1_24:0)+HHexCer 18:1;O2/24:0ME547410---812.6973955
Hex1Cer(d18:1_24:0+O)+HHexCer 18:1;O2/24:0;OME547411---828.6923105
Hex1Cer(d18:1_24:1)+HHexCer 18:1;O2/24:1ME547412---810.6817455
Hex1Cer(d18:1_24:2)+HHexCer 18:1;O2/24:2ME547413---808.6660955
Hex1Cer(d18:1_25:0)+HHexCer 18:1;O2/25:0ME547414---826.7130455
Hex1Cer(d18:1_25:0+O)+HHexCer 18:1;O2/25:0;OME547415---842.7079605
Hex1Cer(d18:1_25:1)+HHexCer 18:1;O2/25:1ME547416---824.6973955
Hex1Cer(d18:1_26:0)+HHexCer 18:1;O2/26:0ME547417---840.7286955
Hex1Cer(d18:1_26:0+O)+HHexCer 18:1;O2/26:0;OME547418---856.7236105
Hex1Cer(d18:1_26:1)+HHexCer 18:1;O2/26:1ME547419---838.7130455
Hex1Cer(d19:2_16:0+O)+HHexCer 19:2;O2/16:0;OME547420---728.5671105
Hex1Cer(d19:2_17:0+O)+HHexCer 19:2;O2/17:0;OME547421---742.5827605
Hex1Cer(d19:2_18:0+O)+HHexCer 19:2;O2/18:0;OME547422---756.5984105
Hex1Cer(d19:2_18:1+O)+HHexCer 19:2;O2/18:1;OME547423---754.5827605
Hex1Cer(d19:2_24:0+O)+HHexCer 19:2;O2/24:0;OME547424---840.6923105
Hex1Cer(d20:0_16:0)+H-H2OHexCer 20:0;O2/16:0ME547425---712.6085805
Hex1Cer(d20:0_18:2)+H-H2OHexCer 20:0;O2/18:2ME547426---736.6085805
Hex1Cer(m20:1_18:2)+HHexCer 20:1;O/18:2ME547434---736.6085805
Hex1Cer(d21:0_17:0)+H-H2OHexCer 21:0;O2/17:0ME547427---740.6398805
Hex1Cer(m21:1_17:0)+HHexCer 21:1;O/17:0ME547435---740.6398805
Hex1Cer(d21:1_17:1)+H-H2OHexCer 21:1;O2/17:1ME547428---736.6085805
Hex1Cer(d21:1_18:1)+H-H2OHexCer 21:1;O2/18:1ME547429---750.6242305
Hex1Cer(d22:1_16:0)+H-H2OHexCer 22:1;O2/16:0ME547430---738.6242305
Hex1Cer(d22:1_17:0)+H-H2OHexCer 22:1;O2/17:0ME547431---752.6398805
Hex1Cer(d22:1_18:1)+H-H2OHexCer 22:1;O2/18:1ME547432---764.6398805
LPC(14:0)+HLPC 14:0ME547455---468.3084685
LPC(15:0)+HLPC 15:0ME547456---482.3241185
LPC(16:0)+HLPC 16:0ME547457---496.3397685
LPC(16:0)+NaLPC 16:0ME547458---518.3217135
LPC(16:1)+HLPC 16:1ME547461---494.3241185
LPC(17:0)+HLPC 17:0ME547464---510.3554185
LPC(17:1)+HLPC 17:1ME547465---508.3397685
LPC(18:0)+HLPC 18:0ME547466---524.3710685
LPC(18:0)+NaLPC 18:0ME547467---546.3530135
LPC(18:1)+HLPC 18:1ME547470---522.3554185
LPC(18:1)+NaLPC 18:1ME547471---544.3373635
LPC(18:2)+HLPC 18:2ME547473---520.3397685
LPC(18:3)+HLPC 18:3ME547475---518.3241185
LPC(19:0)+HLPC 19:0ME547477---538.3867185
LPC(19:1)+HLPC 19:1ME547478---536.3710685
LPC(20:0)+HLPC 20:0ME547479---552.4023685
LPC(20:1)+HLPC 20:1ME547480---550.3867185
LPC(20:2)+HLPC 20:2ME547481---548.3710685
LPC(20:3)+HLPC 20:3ME547482---546.3554185
LPC(20:4)+HLPC 20:4ME547483---544.3397685
LPC(16:0e)+HLPC O-16:0ME547459---482.3605035
LPC(16:0e)+NaLPC O-16:0ME547460---504.3424485
LPC(16:1e)+HLPC O-16:1ME547462---480.3448535
LPC(16:2e)+HLPC O-16:2ME547463---478.3292035
LPC(18:0e)+HLPC O-18:0ME547468---510.3918035
LPC(18:0e)+NaLPC O-18:0ME547469---532.3737485
LPC(18:1e)+HLPC O-18:1ME547472---508.3761535
LPC(18:2e)+HLPC O-18:2ME547474---506.3605035
LPC(18:3e)+HLPC O-18:3ME547476---504.3448535
LPE(16:0)+HLPE 16:0ME547484---454.2928185
LPE(18:0)+NaLPE 18:0ME547485---504.3060635
LPE(18:1e)+NaLPE O-18:1ME547486---488.3111485
LPS(18:0)+HLPS 18:0ME547487---526.3139485
PA(14:1e_18:0)+NH4PA O-14:1/18:0ME547488---650.5119185
PC(24:0_12:3)+HPC 12:3_24:0ME547520---784.5850835
PC(25:0_14:0)+HPC 14:0_25:0ME547521---832.6789835
PC(20:1_14:1)+HPC 14:1_20:1ME547513---758.5694335
PC(22:3_14:1)+HPC 14:1_22:3ME547519---782.5694335
PC(16:0_16:0)+HPC 16:0/16:0ME547493---734.5694335
PC(16:0_16:0)+NaPC 16:0/16:0ME547494---756.5513785
PC(16:0_18:1)+HPC 16:0_18:1ME547495---760.5850835
PC(16:0_18:1)+NaPC 16:0_18:1ME547496---782.5670285
PC(16:0_20:4)+HPC 16:0_20:4ME547497---782.5694335
PC(16:0_22:3)+HPC 16:0_22:3ME547498---812.6163835
PC(16:1_18:1)+HPC 16:1_18:1ME547499---758.5694335
PC(16:1_23:1)+HPC 16:1_23:1ME547500---828.6476835
PC(17:0_18:1)+HPC 17:0_18:1ME547502---774.6007335
PC(17:0_18:2)+HPC 17:0_18:2ME547503---772.5850835
PC(19:1_17:0)+HPC 17:0_19:1ME547508---788.6163835
PC(17:0_20:1)+HPC 17:0_20:1ME547504---802.6320335
PC(17:1_19:1)+HPC 17:1_19:1ME547505---786.6007335
PC(19:1_18:1)+HPC 18:1_19:1ME547509---800.6163835
PC(18:1_20:3)+HPC 18:1_20:3ME547506---810.6007335
PC(19:1_19:1)+HPC 19:1/19:1ME547510---814.6320335
PC(19:1_19:1)+NaPC 19:1/19:1ME547511---836.6139785
PC(19:1_20:1)+HPC 19:1_20:1ME547512---828.6476835
PC(28:0_6:0)+HPC 6:0_28:0ME547522---762.6007335
PC(9:0_24:0)+HPC 9:0_24:0ME547523---748.5850835
PC(10:0e_6:0)+HPC O-10:0_6:0*ME547489---496.3397685
PC(12:1e_6:0)+HPC O-12:1_6:0*ME547490---522.3554185
PC(12:1e_6:0)+NaPC O-12:1_6:0*ME547491---544.3373635
PC(14:0e_20:1)+HPC O-14:0/20:1ME547492---746.6058185
PC(16:1e_16:0)+HPC O-16:1/16:0ME547501---718.5745185
PC(18:3e_16:0)+HPC O-18:3_16:0*ME547507---742.5745185
PC(20:2e_16:0)+HPC O-20:2/16:0ME547514---772.6214685
PC(20:3e_16:0)+HPC O-20:3_16:0*ME547515---770.6058185
PC(20:4e_16:0)+HPC O-20:4_16:0*ME547516---768.5901685
PC(20:4e_16:1)+HPC O-20:4_16:1*ME547517---766.5745185
PC(20:4e_18:1)+HPC O-20:4_18:1*ME547518---794.6058185
PE(16:1_14:0)+HPE 14:0_16:1ME547530---662.4755335
PE(15:0_15:0)+HPE 15:0/15:0ME547524---664.4911835
PE(15:0_16:0)+HPE 15:0_16:0ME547525---678.5068335
PE(15:0_16:1)+HPE 15:0_16:1ME547526---676.4911835
PE(16:0_16:0)+HPE 16:0/16:0ME547527---692.5224835
PE(16:0_18:1)+HPE 16:0_18:1ME547528---718.5381335
PE(16:0_19:0)+HPE 16:0_19:0ME547529---734.5694335
PE(19:1_16:0)+HPE 16:0_19:1ME547536---732.5537835
PE(16:1_16:1)+HPE 16:1/16:1ME547531---688.4911835
PE(16:1_18:1)+HPE 16:1_18:1ME547532---716.5224835
PE(17:1_19:1)+HPE 17:1_19:1ME547533---744.5537835
PE(18:1_18:1)+HPE 18:1/18:1ME547535---744.5537835
PE(19:1_18:1)+HPE 18:1_19:1ME547537---758.5694335
PE(28:1_18:1)+HPE 18:1_28:1ME547539---884.7102835
PE(19:1_19:1)+HPE 19:1/19:1ME547538---772.5850835
PE(18:0p_20:4)+HPE P-18:0/20:4 or PE O-18:1/20:4ME547534---752.5588685
PG(15:0_17:0)+NH4PG 15:0_17:0ME547540---740.5436135
PG(16:0_16:1)+NH4PG 16:0_16:1ME547541---738.5279635
PG(16:0_18:1)+NH4PG 16:0_18:1ME547542---766.5592635
PG(19:1_18:1)+NH4PG 18:1_19:1ME547543---806.5905635
PG(30:0_18:1)+HPG 18:1_30:0ME547544---945.7518145
PI(16:0_16:1)+HPI 16:0_16:1ME547545---809.5174595
PI(16:0_16:1)+NH4PI 16:0_16:1ME547546---826.5440085
PI(16:0_18:1)+NH4PI 16:0_18:1ME547547---854.5753085
PI(16:0_19:0)+HPI 16:0_19:0ME547548---853.5800595
PI(16:0_19:0)+NH4PI 16:0_19:0ME547549---870.6066085
PI(18:0_20:4)+NH4PI 18:0_20:4ME547550---904.5909585
PS(18:0_18:1)+HPS 18:0_18:1ME547551---790.5592635
SM(d16:1_24:1)+HSM 16:1;O2/24:1ME547552---785.6531025
SM(d17:0_21:2)+HSM 17:0;O2/21:2ME547553---757.6218025
SM(d18:0_15:1)+HSM 18:0;O2/15:1ME547554---689.5592025
SM(d18:0_18:3)+HSM 18:0;O2/18:3ME547555---727.5748525
SM(t18:0_16:0)+HSM 18:0;O3/16:0ME547575---721.5854175
SM(t18:0_16:1)+HSM 18:0;O3/16:1ME547576---719.5697675
SM(d18:1_14:0)+HSM 18:1;O2/14:0ME547556---675.5435525
SM(d18:1_14:0)+NaSM 18:1;O2/14:0ME547557---697.5254975
SM(d18:1_16:0)+NaSM 18:1;O2/16:0ME547558---725.5567975
SM(d18:1_18:0)+NaSM 18:1;O2/18:0ME547559---753.5880975
SM(d18:1_18:3)+HSM 18:1;O2/18:3ME547560---725.5592025
SM(d18:1_20:3)+HSM 18:1;O2/20:3ME547561---753.5905025
SM(d18:1_22:0)+HSM 18:1;O2/22:0ME547562---787.6687525
SM(d18:1_22:0)+NaSM 18:1;O2/22:0ME547563---809.6506975
SM(d18:1_22:2)+HSM 18:1;O2/22:2ME547564---783.6374525
SM(d18:1_23:0)+HSM 18:1;O2/23:0ME547565---801.6844025
SM(d18:1_23:1)+HSM 18:1;O2/23:1ME547566---799.6687525
SM(d18:1_24:0)+HSM 18:1;O2/24:0ME547567---815.7000525
SM(d18:1_24:0)+NaSM 18:1;O2/24:0ME547568---837.6819975
SM(d18:1_24:1)+HSM 18:1;O2/24:1ME547569---813.6844025
SM(d18:1_24:1)+NaSM 18:1;O2/24:1ME547570---835.6663475
SM(d18:1_24:2)+NaSM 18:1;O2/24:2ME547571---833.6506975
SM(d18:1_24:3)+HSM 18:1;O2/24:3ME547572---809.6531025
SM(t18:1_24:1)+HSM 18:1;O3/24:1ME547577---829.6793175
SM(d18:2_18:3)+HSM 18:2;O2/18:3ME547573---723.5435525
SM(d18:2_24:3)+HSM 18:2;O2/24:3ME547574---807.6374525
TG(10:0_10:0_18:1)+NH4TG 10:0_10:0_18:1ME547578---682.5980155
TG(10:0_14:0_14:0)+NH4TG 10:0_14:0_14:0ME547579---684.6136655
TG(15:0_10:1_10:1)+NH4TG 10:1_10:1_15:0ME547599---638.5354155
TG(15:0_10:1_18:1)+NH4TG 10:1_15:0_18:1ME547600---750.6606155
TG(18:1_10:1_18:2)+NH4TG 10:1_18:1_18:2ME547830---788.6762655
TG(18:2_10:1_18:2)+NH4TG 10:1_18:2_18:2ME547914---786.6606155
TG(17:1_10:2_10:2)+HTG 10:2_10:2_17:1ME547788---643.4932165
TG(26:0_10:2_20:5)+HTG 10:2_20:5_26:0ME547964---905.7592665
TG(22:5_10:2_23:0)+HTG 10:2_22:5_23:0ME547963---891.7436165
TG(18:1_10:3_24:1)+HTG 10:3_18:1_24:1ME547831---853.7279665
TG(16:0_11:1_14:0)+NH4TG 11:1_14:0_16:0ME547629---724.6449655
TG(18:1_11:1_18:1)+NaTG 11:1_18:1_18:1ME547832---809.6629615
TG(18:1_11:2_18:1)+NaTG 11:2_18:1_18:1ME547833---807.6473115
TG(16:0_11:3_18:1)+HTG 11:3_16:0_18:1ME547630---757.6340665
TG(18:1_11:3_18:1)+NH4TG 11:3_18:1_18:1ME547834---800.6762655
TG(20:1_11:3_18:1)+HTG 11:3_18:1_20:1ME547949---811.6810165
TG(18:1_11:3_20:2)+HTG 11:3_18:1_20:2ME547835---809.6653665
TG(16:0_11:4_18:1)+HTG 11:4_16:0_18:1ME547631---755.6184165
TG(18:1_11:4_20:2)+NH4TG 11:4_18:1_20:2ME547836---824.6762655
TG(12:0_12:0_12:0)+NH4TG 12:0/12:0/12:0ME547580---656.5823655
TG(12:0_12:0_14:0)+NH4TG 12:0_12:0_14:0ME547581---684.6136655
TG(12:0_12:0_14:1)+NH4TG 12:0_12:0_14:1ME547582---682.5980155
TG(16:1_12:0_12:0)+NH4TG 12:0_12:0_16:1ME547730---710.6293155
TG(12:0_14:0_14:0)+NH4TG 12:0_14:0_14:0ME547583---712.6449655
TG(16:0_12:0_14:0)+NaTG 12:0_14:0_16:0ME547632---745.6316615
TG(16:0_12:0_14:0)+NH4TG 12:0_14:0_16:0ME547633---740.6762655
TG(18:1_12:0_14:0)+NaTG 12:0_14:0_18:1ME547837---771.6473115
TG(18:1_12:0_14:0)+NH4TG 12:0_14:0_18:1ME547838---766.6919155
TG(16:1_12:0_14:1)+NH4TG 12:0_14:1_16:1ME547731---736.6449655
TG(15:0_12:0_16:0)+NH4TG 12:0_15:0_16:0ME547601---754.6919155
TG(15:0_12:0_16:1)+NH4TG 12:0_15:0_16:1ME547602---752.6762655
TG(16:0_12:0_18:1)+NH4TG 12:0_16:0_18:1ME547634---794.7232155
TG(16:0_12:0_18:3)+HTG 12:0_16:0_18:3ME547635---773.6653665
TG(16:0_12:0_20:5)+HTG 12:0_16:0_20:5ME547636---797.6653665
TG(16:1_12:0_16:1)+NH4TG 12:0_16:1_16:1ME547732---764.6762655
TG(16:1_12:0_17:1)+NH4TG 12:0_16:1_17:1ME547733---778.6919155
TG(16:1_12:0_18:1)+NaTG 12:0_16:1_18:1ME547734---797.6629615
TG(16:1_12:0_18:1)+NH4TG 12:0_16:1_18:1ME547735---792.7075655
TG(18:1_12:0_18:2)+NH4TG 12:0_18:1_18:2ME547839---818.7232155
TG(18:1_12:0_18:3)+HTG 12:0_18:1_18:3ME547840---799.6810165
TG(18:1_12:0_20:5)+HTG 12:0_18:1_20:5ME547841---823.6810165
TG(12:0_18:2_18:3)+NH4TG 12:0_18:2_18:3ME547584---814.6919155
TG(12:0_18:2_20:5)+HTG 12:0_18:2_20:5ME547585---821.6653665
TG(16:0_12:1_18:1)+NH4TG 12:1_16:0_18:1ME547637---792.7075655
TG(16:1_12:1_18:2)+NH4TG 12:1_16:1_18:2ME547736---788.6762655
TG(18:1_12:2_18:1)+HTG 12:2_18:1_18:1ME547842---799.6810165
TG(18:1_12:2_18:1)+NH4TG 12:2_18:1_18:1ME547843---816.7075655
TG(18:2_13:0_18:2)+NH4TG 13:0_18:2_18:2ME547915---830.7232155
TG(16:0_14:0_14:0)+NaTG 14:0_14:0_16:0ME547638---773.6629615
TG(16:0_14:0_14:0)+NH4TG 14:0_14:0_16:0ME547639---768.7075655
TG(18:1_14:0_14:0)+NH4TG 14:0_14:0_18:1ME547844---794.7232155
TG(15:0_14:0_16:0)+NH4TG 14:0_15:0_16:0ME547603---782.7232155
TG(15:0_14:0_16:1)+NH4TG 14:0_15:0_16:1ME547604---780.7075655
TG(16:0_14:0_16:0)+NH4TG 14:0_16:0_16:0ME547640---796.7388655
TG(16:0_14:0_16:1)+NaTG 14:0_16:0_16:1ME547641---799.6786115
TG(16:0_14:0_16:1)+NH4TG 14:0_16:0_16:1ME547642---794.7232155
TG(16:0_14:0_17:0)+NH4TG 14:0_16:0_17:0ME547643---810.7545155
TG(18:0_14:0_16:0)+NH4TG 14:0_16:0_18:0ME547789---824.7701655
TG(16:0_14:0_18:1)+NaTG 14:0_16:0_18:1ME547644---827.7099115
TG(16:0_14:0_18:1)+NH4TG 14:0_16:0_18:1ME547645---822.7545155
TG(16:0_14:0_18:3)+HTG 14:0_16:0_18:3ME547646---801.6966665
TG(16:0_14:0_20:2)+NaTG 14:0_16:0_20:2ME547647---853.7255615
TG(16:0_14:0_20:4)+HTG 14:0_16:0_20:4ME547648---827.7123165
TG(16:0_14:0_20:4)+NH4TG 14:0_16:0_20:4ME547649---844.7388655
TG(16:0_14:0_22:6)+NH4TG 14:0_16:0_22:6ME547650---868.7388655
TG(16:1_14:0_18:1)+NH4TG 14:0_16:1_18:1ME547737---820.7388655
TG(18:1_14:0_18:3)+NH4TG 14:0_18:1_18:3ME547845---844.7388655
TG(18:4_14:0_18:1)+HTG 14:0_18:1_18:4ME547924---825.6966665
TG(18:1_14:0_20:5)+HTG 14:0_18:1_20:5ME547846---851.7123165
TG(14:0_18:2_20:5)+HTG 14:0_18:2_20:5ME547592---849.6966665
TG(16:0_14:1_16:1)+NH4TG 14:1_16:0_16:1ME547651---792.7075655
TG(16:1_14:1_16:1)+NH4TG 14:1_16:1_16:1ME547738---790.6919155
TG(16:1_14:1_17:1)+NH4TG 14:1_16:1_17:1ME547739---804.7075655
TG(16:1_14:1_18:1)+NH4TG 14:1_16:1_18:1ME547740---818.7232155
TG(16:1_14:1_18:2)+NH4TG 14:1_16:1_18:2ME547741---816.7075655
TG(18:1_14:1_18:1)+NaTG 14:1_18:1_18:1ME547847---851.7099115
TG(18:2_14:1_18:2)+NH4TG 14:1_18:2_18:2ME547916---842.7232155
TG(18:1_14:2_18:1)+HTG 14:2_18:1_18:1ME547848---827.7123165
TG(18:0_14:3_18:2)+HTG 14:3_18:0_18:2ME547790---825.6966665
TG(16:0_14:4_18:1)+HTG 14:4_16:0_18:1ME547652---797.6653665
TG(18:1_14:4_18:1)+HTG 14:4_18:1_18:1ME547849---823.6810165
TG(15:0_16:0_16:0)+NH4TG 15:0_16:0_16:0ME547605---810.7545155
TG(15:0_16:0_16:1)+NH4TG 15:0_16:0_16:1ME547606---808.7388655
TG(15:0_16:0_18:1)+NaTG 15:0_16:0_18:1ME547607---841.7255615
TG(15:0_16:0_18:1)+NH4TG 15:0_16:0_18:1ME547608---836.7701655
TG(15:0_16:0_18:2)+NaTG 15:0_16:0_18:2ME547609---839.7099115
TG(15:0_16:0_18:2)+NH4TG 15:0_16:0_18:2ME547610---834.7545155
TG(15:0_16:0_20:5)+HTG 15:0_16:0_20:5ME547611---839.7123165
TG(15:0_16:1_16:1)+NH4TG 15:0_16:1_16:1ME547612---806.7232155
TG(15:0_16:1_18:1)+NH4TG 15:0_16:1_18:1ME547613---834.7545155
TG(15:0_16:1_18:2)+NaTG 15:0_16:1_18:2ME547614---837.6942615
TG(15:0_16:1_18:2)+NH4TG 15:0_16:1_18:2ME547615---832.7388655
TG(15:0_16:1_20:5)+HTG 15:0_16:1_20:5ME547616---837.6966665
TG(15:0_18:1_18:1)+NH4TG 15:0_18:1_18:1ME547617---862.7858155
TG(15:0_18:1_18:2)+NaTG 15:0_18:1_18:2ME547618---865.7255615
TG(15:0_18:1_18:2)+NH4TG 15:0_18:1_18:2ME547619---860.7701655
TG(15:0_18:1_18:3)+HTG 15:0_18:1_18:3ME547620---841.7279665
TG(15:0_18:1_20:4)+HTG 15:0_18:1_20:4ME547621---867.7436165
TG(15:0_18:1_20:4)+NH4TG 15:0_18:1_20:4ME547622---884.7701655
TG(15:0_18:1_20:5)+HTG 15:0_18:1_20:5ME547623---865.7279665
TG(15:0_18:2_18:2)+NH4TG 15:0_18:2_18:2ME547624---858.7545155
TG(15:0_18:2_18:3)+NH4TG 15:0_18:2_18:3ME547625---856.7388655
TG(15:0_18:2_20:5)+HTG 15:0_18:2_20:5ME547626---863.7123165
TG(16:0_16:0_16:0)+NaTG 16:0/16:0/16:0ME547653---829.7255615
TG(16:0_16:0_16:0)+NH4TG 16:0/16:0/16:0ME547654---824.7701655
TG(16:0_16:0_17:0)+NH4TG 16:0_16:0_17:0ME547655---838.7858155
TG(18:0_16:0_16:0)+NaTG 16:0_16:0_18:0ME547791---857.7568615
TG(18:0_16:0_16:0)+NH4TG 16:0_16:0_18:0ME547792---852.8014655
TG(16:0_16:0_18:1)+NaTG 16:0_16:0_18:1ME547656---855.7412115
TG(16:0_16:0_18:1)+NH4TG 16:0_16:0_18:1ME547657---850.7858155
TG(16:0_16:0_18:3)+HTG 16:0_16:0_18:3ME547658---829.7279665
TG(18:4_16:0_16:0)+HTG 16:0_16:0_18:4ME547925---827.7123165
TG(20:0_16:0_16:0)+NaTG 16:0_16:0_20:0ME547941---885.7881615
TG(20:0_16:0_16:0)+NH4TG 16:0_16:0_20:0ME547942---880.8327655
TG(16:0_16:0_20:2)+NaTG 16:0_16:0_20:2ME547659---881.7568615
TG(16:0_16:0_20:4)+HTG 16:0_16:0_20:4ME547660---855.7436165
TG(16:0_16:0_20:4)+NH4TG 16:0_16:0_20:4ME547661---872.7701655
TG(16:0_16:0_22:2)+NaTG 16:0_16:0_22:2ME547662---909.7881615
TG(16:0_16:0_22:5)+NH4TG 16:0_16:0_22:5ME547663---898.7858155
TG(16:0_16:0_22:6)+NH4TG 16:0_16:0_22:6ME547664---896.7701655
TG(16:0_16:0_24:0)+NH4TG 16:0_16:0_24:0ME547665---936.8953655
TG(16:0_16:1_16:1)+NaTG 16:0_16:1_16:1ME547666---825.6942615
TG(16:0_16:1_16:1)+NH4TG 16:0_16:1_16:1ME547667---820.7388655
TG(16:0_16:1_18:1)+NaTG 16:0_16:1_18:1ME547668---853.7255615
TG(16:0_16:1_18:1)+NH4TG 16:0_16:1_18:1ME547669---848.7701655
TG(16:0_16:1_18:2)+NH4TG 16:0_16:1_18:2ME547670---846.7545155
TG(16:0_16:1_18:3)+HTG 16:0_16:1_18:3ME547671---827.7123165
TG(18:4_16:0_16:1)+HTG 16:0_16:1_18:4ME547926---825.6966665
TG(16:0_16:1_20:5)+HTG 16:0_16:1_20:5ME547672---851.7123165
TG(16:0_16:1_22:6)+NH4TG 16:0_16:1_22:6ME547673---894.7545155
TG(18:0_16:0_17:0)+NH4TG 16:0_17:0_18:0ME547793---866.8171155
TG(16:0_17:0_18:1)+NaTG 16:0_17:0_18:1ME547674---869.7568615
TG(16:0_17:0_18:1)+NH4TG 16:0_17:0_18:1ME547675---864.8014655
TG(16:0_17:0_20:4)+HTG 16:0_17:0_20:4ME547676---869.7592665
TG(18:0_16:0_17:1)+NH4TG 16:0_17:1_18:0ME547794---864.8014655
TG(16:0_17:1_18:1)+NaTG 16:0_17:1_18:1ME547677---867.7412115
TG(16:0_17:1_18:1)+NH4TG 16:0_17:1_18:1ME547678---862.7858155
TG(18:0_16:0_18:0)+NH4TG 16:0_18:0_18:0ME547795---880.8327655
TG(18:0_16:0_18:1)+NaTG 16:0_18:0_18:1ME547796---883.7725115
TG(18:0_16:0_18:1)+NH4TG 16:0_18:0_18:1ME547797---878.8171155
TG(18:0_16:0_18:3)+HTG 16:0_18:0_18:3ME547798---857.7592665
TG(18:0_16:0_18:3)+NH4TG 16:0_18:0_18:3ME547799---874.7858155
TG(16:0_18:1_18:1)+HTG 16:0_18:1_18:1ME547679---859.7749165
TG(16:0_18:1_18:1)+NaTG 16:0_18:1_18:1ME547680---881.7568615
TG(16:0_18:1_18:1)+NH4TG 16:0_18:1_18:1ME547681---876.8014655
TG(16:0_18:1_18:2)+HTG 16:0_18:1_18:2ME547682---857.7592665
TG(16:0_18:1_18:2)+NaTG 16:0_18:1_18:2ME547683---879.7412115
TG(16:0_18:1_18:2)+NH4TG 16:0_18:1_18:2ME547684---874.7858155
TG(16:0_18:1_18:3)+HTG 16:0_18:1_18:3ME547685---855.7436165
TG(16:0_18:1_18:3)+NH4TG 16:0_18:1_18:3ME547686---872.7701655
TG(16:0_18:1_19:0)+NH4TG 16:0_18:1_19:0ME547687---892.8327655
TG(16:0_18:1_20:1)+NH4TG 16:0_18:1_20:1ME547688---904.8327655
TG(16:0_18:1_20:4)+NH4TG 16:0_18:1_20:4ME547689---898.7858155
TG(16:0_18:1_21:0)+NH4TG 16:0_18:1_21:0ME547690---920.8640655
TG(16:0_18:1_22:0)+NH4TG 16:0_18:1_22:0ME547691---934.8797155
TG(16:0_18:1_22:2)+NaTG 16:0_18:1_22:2ME547692---935.8038115
TG(16:0_18:1_22:5)+HTG 16:0_18:1_22:5ME547693---907.7749165
TG(16:0_18:1_22:5)+NH4TG 16:0_18:1_22:5ME547694---924.8014655
TG(16:0_18:1_22:6)+HTG 16:0_18:1_22:6ME547695---905.7592665
TG(16:0_18:1_22:6)+NH4TG 16:0_18:1_22:6ME547696---922.7858155
TG(16:0_18:1_23:0)+NH4TG 16:0_18:1_23:0ME547697---948.8953655
TG(16:0_18:1_23:1)+NH4TG 16:0_18:1_23:1ME547698---946.8797155
TG(16:0_18:1_24:0)+NH4TG 16:0_18:1_24:0ME547699---962.9110155
TG(16:0_18:2_18:2)+NH4TG 16:0_18:2_18:2ME547700---872.7701655
TG(16:0_18:2_18:3)+HTG 16:0_18:2_18:3ME547701---853.7279665
TG(16:0_18:2_18:3)+NH4TG 16:0_18:2_18:3ME547702---870.7545155
TG(16:0_18:2_20:5)+HTG 16:0_18:2_20:5ME547703---877.7279665
TG(16:0_18:2_22:6)+NaTG 16:0_18:2_22:6ME547704---925.7255615
TG(16:0_18:2_22:6)+NH4TG 16:0_18:2_22:6ME547705---920.7701655
TG(16:0_18:3_18:3)+HTG 16:0_18:3_18:3ME547706---851.7123165
TG(16:0_18:3_19:0)+NH4TG 16:0_18:3_19:0ME547707---888.8014655
TG(16:0_18:3_20:2)+HTG 16:0_18:3_20:2ME547708---881.7592665
TG(16:0_18:3_20:3)+HTG 16:0_18:3_20:3ME547709---879.7436165
TG(16:0_18:3_22:4)+HTG 16:0_18:3_22:4ME547710---905.7592665
TG(16:1_16:1_16:1)+NaTG 16:1/16:1/16:1ME547742---823.6786115
TG(16:1_16:1_16:1)+NH4TG 16:1/16:1/16:1ME547743---818.7232155
TG(18:0_16:1_16:1)+NH4TG 16:1_16:1_18:0ME547800---848.7701655
TG(16:1_16:1_18:1)+NaTG 16:1_16:1_18:1ME547744---851.7099115
TG(16:1_16:1_18:1)+NH4TG 16:1_16:1_18:1ME547745---846.7545155
TG(16:1_16:1_18:2)+NaTG 16:1_16:1_18:2ME547746---849.6942615
TG(16:1_16:1_18:2)+NH4TG 16:1_16:1_18:2ME547747---844.7388655
TG(16:1_16:1_18:3)+HTG 16:1_16:1_18:3ME547748---825.6966665
TG(16:1_16:1_20:5)+NaTG 16:1_16:1_20:5ME547749---871.6786115
TG(16:1_16:1_20:5)+NH4TG 16:1_16:1_20:5ME547750---866.7232155
TG(16:1_17:0_18:2)+NH4TG 16:1_17:0_18:2ME547751---860.7701655
TG(16:1_17:1_18:1)+NH4TG 16:1_17:1_18:1ME547752---860.7701655
TG(16:1_17:1_18:2)+NH4TG 16:1_17:1_18:2ME547753---858.7545155
TG(18:0_16:1_18:2)+NH4TG 16:1_18:0_18:2ME547801---874.7858155
TG(16:1_18:1_18:2)+NaTG 16:1_18:1_18:2ME547754---877.7255615
TG(16:1_18:1_18:2)+NH4TG 16:1_18:1_18:2ME547755---872.7701655
TG(16:1_18:1_18:3)+HTG 16:1_18:1_18:3ME547756---853.7279665
TG(16:1_18:1_18:3)+NH4TG 16:1_18:1_18:3ME547757---870.7545155
TG(18:4_16:1_18:1)+HTG 16:1_18:1_18:4ME547927---851.7123165
TG(16:1_18:1_20:2)+HTG 16:1_18:1_20:2ME547758---883.7749165
TG(16:1_18:1_20:4)+HTG 16:1_18:1_20:4ME547759---879.7436165
TG(16:1_18:1_20:5)+HTG 16:1_18:1_20:5ME547760---877.7279665
TG(16:1_18:2_18:2)+NaTG 16:1_18:2_18:2ME547761---875.7099115
TG(16:1_18:2_18:2)+NH4TG 16:1_18:2_18:2ME547762---870.7545155
TG(16:1_18:2_18:3)+NaTG 16:1_18:2_18:3ME547763---873.6942615
TG(16:1_18:2_18:3)+NH4TG 16:1_18:2_18:3ME547764---868.7388655
TG(16:1_18:2_20:5)+HTG 16:1_18:2_20:5ME547765---875.7123165
TG(16:1_20:3_20:5)+NH4TG 16:1_20:3_20:5ME547766---918.7545155
TG(17:0_17:0_18:1)+NH4TG 17:0_17:0_18:1ME547778---878.8171155
TG(18:0_17:0_18:1)+NH4TG 17:0_18:0_18:1ME547802---892.8327655
TG(17:0_18:1_18:1)+NaTG 17:0_18:1_18:1ME547779---895.7725115
TG(17:0_18:1_18:1)+NH4TG 17:0_18:1_18:1ME547780---890.8171155
TG(17:0_18:1_20:4)+HTG 17:0_18:1_20:4ME547781---895.7749165
TG(17:0_18:1_22:4)+NH4TG 17:0_18:1_22:4ME547782---940.8327655
TG(17:0_18:2_18:2)+NH4TG 17:0_18:2_18:2ME547783---886.7858155
TG(17:0_18:2_20:5)+HTG 17:0_18:2_20:5ME547784---891.7436165
TG(18:1_17:1_18:1)+NaTG 17:1_18:1_18:1ME547850---893.7568615
TG(18:1_17:1_18:1)+NH4TG 17:1_18:1_18:1ME547851---888.8014655
TG(18:1_17:1_18:2)+NaTG 17:1_18:1_18:2ME547852---891.7412115
TG(18:1_17:1_18:2)+NH4TG 17:1_18:1_18:2ME547853---886.7858155
TG(18:1_17:1_20:4)+HTG 17:1_18:1_20:4ME547854---893.7592665
TG(18:1_17:1_20:4)+NH4TG 17:1_18:1_20:4ME547855---910.7858155
TG(18:2_17:1_18:2)+NH4TG 17:1_18:2_18:2ME547917---884.7701655
TG(18:3_17:1_18:2)+NH4TG 17:1_18:2_18:3ME547921---882.7545155
TG(20:5_17:1_18:2)+HTG 17:1_18:2_20:5ME547961---889.7279665
TG(18:0_18:0_18:0)+NH4TG 18:0/18:0/18:0ME547803---908.8640655
TG(18:0_18:0_18:1)+NaTG 18:0_18:0_18:1ME547804---911.8038115
TG(18:0_18:0_18:1)+NH4TG 18:0_18:0_18:1ME547805---906.8484155
TG(18:0_18:0_18:3)+HTG 18:0_18:0_18:3ME547806---885.7905665
TG(18:0_18:0_20:4)+NH4TG 18:0_18:0_20:4ME547807---928.8327655
TG(18:0_18:1_18:1)+NaTG 18:0_18:1_18:1ME547808---909.7881615
TG(18:0_18:1_18:1)+NH4TG 18:0_18:1_18:1ME547809---904.8327655
TG(18:0_18:1_18:3)+HTG 18:0_18:1_18:3ME547810---883.7749165
TG(18:0_18:1_18:3)+NH4TG 18:0_18:1_18:3ME547811---900.8014655
TG(18:0_18:1_19:0)+NH4TG 18:0_18:1_19:0ME547812---920.8640655
TG(18:0_18:1_20:0)+NH4TG 18:0_18:1_20:0ME547813---934.8797155
TG(18:0_18:1_20:4)+HTG 18:0_18:1_20:4ME547814---909.7905665
TG(18:0_18:1_20:5)+HTG 18:0_18:1_20:5ME547815---907.7749165
TG(18:0_18:1_22:4)+NH4TG 18:0_18:1_22:4ME547816---954.8484155
TG(18:0_18:1_22:6)+NH4TG 18:0_18:1_22:6ME547817---950.8171155
TG(18:0_18:2_18:2)+NH4TG 18:0_18:2_18:2ME547818---900.8014655
TG(18:0_18:2_22:4)+HTG 18:0_18:2_22:4ME547819---935.8062165
TG(18:1_18:1_18:1)+NaTG 18:1/18:1/18:1ME547856---907.7725115
TG(18:1_18:1_18:1)+NH4TG 18:1/18:1/18:1ME547857---902.8171155
TG(18:1_18:1_18:2)+NaTG 18:1_18:1_18:2ME547858---905.7568615
TG(18:1_18:1_18:2)+NH4TG 18:1_18:1_18:2ME547859---900.8014655
TG(18:1_18:1_18:3)+HTG 18:1_18:1_18:3ME547860---881.7592665
TG(18:4_18:1_18:1)+HTG 18:1_18:1_18:4ME547928---879.7436165
TG(19:0_18:1_18:1)+NH4TG 18:1_18:1_19:0ME547931---918.8484155
TG(19:1_18:1_18:1)+NaTG 18:1_18:1_19:1ME547934---921.7881615
TG(19:1_18:1_18:1)+NH4TG 18:1_18:1_19:1ME547935---916.8327655
TG(20:0_18:1_18:1)+NaTG 18:1_18:1_20:0ME547943---937.8194615
TG(20:0_18:1_18:1)+NH4TG 18:1_18:1_20:0ME547944---932.8640655
TG(20:1_18:1_18:1)+NaTG 18:1_18:1_20:1ME547950---935.8038115
TG(20:1_18:1_18:1)+NH4TG 18:1_18:1_20:1ME547951---930.8484155
TG(18:1_18:1_20:2)+HTG 18:1_18:1_20:2ME547861---911.8062165
TG(18:1_18:1_20:3)+NH4TG 18:1_18:1_20:3ME547862---926.8171155
TG(18:1_18:1_20:4)+HTG 18:1_18:1_20:4ME547863---907.7749165
TG(18:1_18:1_20:4)+NH4TG 18:1_18:1_20:4ME547864---924.8014655
TG(18:1_18:1_20:5)+HTG 18:1_18:1_20:5ME547865---905.7592665
TG(18:1_18:1_21:0)+NH4TG 18:1_18:1_21:0ME547866---946.8797155
TG(18:1_18:1_21:1)+NH4TG 18:1_18:1_21:1ME547867---944.8640655
TG(18:1_18:1_22:0)+NH4TG 18:1_18:1_22:0ME547868---960.8953655
TG(18:1_18:1_22:1)+NaTG 18:1_18:1_22:1ME547869---963.8351115
TG(18:1_18:1_22:1)+NH4TG 18:1_18:1_22:1ME547870---958.8797155
TG(18:1_18:1_22:2)+NaTG 18:1_18:1_22:2ME547871---961.8194615
TG(18:1_18:1_22:3)+HTG 18:1_18:1_22:3ME547872---937.8218665
TG(18:1_18:1_22:3)+NH4TG 18:1_18:1_22:3ME547873---954.8484155
TG(18:1_18:1_22:4)+NH4TG 18:1_18:1_22:4ME547874---952.8327655
TG(18:1_18:1_22:5)+HTG 18:1_18:1_22:5ME547875---933.7905665
TG(18:1_18:1_22:5)+NH4TG 18:1_18:1_22:5ME547876---950.8171155
TG(18:1_18:1_22:6)+NaTG 18:1_18:1_22:6ME547877---953.7568615
TG(18:1_18:1_22:6)+NH4TG 18:1_18:1_22:6ME547878---948.8014655
TG(18:1_18:1_23:0)+NH4TG 18:1_18:1_23:0ME547879---974.9110155
TG(18:1_18:1_24:0)+NH4TG 18:1_18:1_24:0ME547880---988.9266655
TG(18:1_18:1_24:1)+NH4TG 18:1_18:1_24:1ME547881---986.9110155
TG(18:1_18:2_18:2)+NaTG 18:1_18:2_18:2ME547882---903.7412115
TG(18:1_18:2_18:2)+NH4TG 18:1_18:2_18:2ME547883---898.7858155
TG(18:1_18:2_18:3)+HTG 18:1_18:2_18:3ME547884---879.7436165
TG(18:1_18:2_18:3)+NaTG 18:1_18:2_18:3ME547885---901.7255615
TG(18:1_18:2_18:3)+NH4TG 18:1_18:2_18:3ME547886---896.7701655
TG(19:1_18:1_18:2)+NH4TG 18:1_18:2_19:1ME547936---914.8171155
TG(20:0_18:1_18:2)+NaTG 18:1_18:2_20:0ME547945---935.8038115
TG(20:0_18:1_18:2)+NH4TG 18:1_18:2_20:0ME547946---930.8484155
TG(20:1_18:1_18:2)+NaTG 18:1_18:2_20:1ME547952---933.7881615
TG(20:1_18:1_18:2)+NH4TG 18:1_18:2_20:1ME547953---928.8327655
TG(18:1_18:2_20:2)+HTG 18:1_18:2_20:2ME547887---909.7905665
TG(18:1_18:2_20:2)+NH4TG 18:1_18:2_20:2ME547888---926.8171155
TG(18:1_18:2_20:3)+HTG 18:1_18:2_20:3ME547889---907.7749165
TG(18:1_18:2_20:3)+NaTG 18:1_18:2_20:3ME547890---929.7568615
TG(18:1_18:2_20:3)+NH4TG 18:1_18:2_20:3ME547891---924.8014655
TG(18:1_18:2_20:4)+HTG 18:1_18:2_20:4ME547892---905.7592665
TG(18:1_18:2_20:4)+NaTG 18:1_18:2_20:4ME547893---927.7412115
TG(18:1_18:2_20:4)+NH4TG 18:1_18:2_20:4ME547894---922.7858155
TG(18:1_18:2_20:5)+HTG 18:1_18:2_20:5ME547895---903.7436165
TG(18:1_18:2_22:1)+NH4TG 18:1_18:2_22:1ME547896---956.8640655
TG(18:1_18:2_22:3)+HTG 18:1_18:2_22:3ME547897---935.8062165
TG(18:1_18:2_22:4)+NH4TG 18:1_18:2_22:4ME547898---950.8171155
TG(18:1_18:2_22:5)+NH4TG 18:1_18:2_22:5ME547899---948.8014655
TG(18:1_18:2_22:6)+NH4TG 18:1_18:2_22:6ME547900---946.7858155
TG(18:1_18:2_24:1)+NH4TG 18:1_18:2_24:1ME547901---984.8953655
TG(18:1_18:2_24:2)+NH4TG 18:1_18:2_24:2ME547902---982.8797155
TG(19:0_18:1_18:3)+NH4TG 18:1_18:3_19:0ME547932---914.8171155
TG(18:1_18:3_22:2)+HTG 18:1_18:3_22:2ME547903---935.8062165
TG(18:4_18:1_22:5)+NaTG 18:1_18:4_22:5ME547929---949.7255615
TG(19:1_18:1_20:1)+NH4TG 18:1_19:1_20:1ME547937---944.8640655
TG(20:0_18:1_20:4)+HTG 18:1_20:0_20:4ME547947---937.8218665
TG(20:0_18:1_22:6)+HTG 18:1_20:0_22:6ME547948---961.8218665
TG(20:1_18:1_20:4)+HTG 18:1_20:1_20:4ME547954---935.8062165
TG(18:1_20:2_22:4)+NH4TG 18:1_20:2_22:4ME547904---978.8484155
TG(18:1_20:4_20:4)+HTG 18:1_20:4_20:4ME547905---929.7592665
TG(18:2_18:2_18:2)+NH4TG 18:2/18:2/18:2ME547918---896.7701655
TG(18:3_18:2_18:2)+NaTG 18:2_18:2_18:3ME547922---899.7099115
TG(18:3_18:2_18:2)+NH4TG 18:2_18:2_18:3ME547923---894.7545155
TG(19:1_18:2_18:2)+NH4TG 18:2_18:2_19:1ME547938---912.8014655
TG(20:5_18:2_18:2)+HTG 18:2_18:2_20:5ME547962---901.7279665
TG(18:2_18:2_22:6)+NH4TG 18:2_18:2_22:6ME547919---944.7701655
TG(18:2_20:4_20:4)+HTG 18:2_20:4_20:4ME547920---927.7436165
TG(34:2)+NH4TG 34:2ME547966---624.5197655
TG(4:0_12:0_16:1)+NH4TG 4:0_12:0_16:1ME547967---598.5041155
TG(4:0_14:2_18:3)+HTG 4:0_14:2_18:3ME547968---629.4775665
TG(4:0_14:2_18:3)+NaTG 4:0_14:2_18:3ME547969---651.4595115
TG(4:0_6:0_11:2)+NH4TG 4:0_6:0_11:2ME547970---442.3163155
TG(6:0_10:0_12:2)+HTG 6:0_10:0_12:2ME547971---523.3993165
TG(6:0_10:0_18:1)+NH4TG 6:0_10:0_18:1ME547972---626.5354155
TG(6:0_10:1_17:1)+NH4TG 6:0_10:1_17:1ME547973---610.5041155
TG(17:0_6:0_10:2)+NH4TG 6:0_10:2_17:0ME547785---610.5041155
TG(6:0_10:2_17:1)+HTG 6:0_10:2_17:1ME547974---591.4619165
TG(6:0_10:2_17:1)+NH4TG 6:0_10:2_17:1ME547975---608.4884655
TG(19:0_6:0_10:2)+NaTG 6:0_10:2_19:0ME547933---643.4908115
TG(19:1_6:0_10:2)+NH4TG 6:0_10:2_19:1ME547939---636.5197655
TG(17:0_6:0_10:3)+HTG 6:0_10:3_17:0ME547786---591.4619165
TG(17:0_6:0_10:3)+NH4TG 6:0_10:3_17:0ME547787---608.4884655
TG(15:0_6:0_11:1)+NH4TG 6:0_11:1_15:0ME547627---598.5041155
TG(16:1_6:0_11:2)+HTG 6:0_11:2_16:1ME547767---591.4619165
TG(18:0_6:0_11:2)+NH4TG 6:0_11:2_18:0ME547820---638.5354155
TG(6:0_11:2_18:2)+NaTG 6:0_11:2_18:2ME547976---639.4595115
TG(6:0_11:2_20:5)+HTG 6:0_11:2_20:5ME547977---639.4619165
TG(16:0_6:0_11:3)+HTG 6:0_11:3_16:0ME547711---591.4619165
TG(16:1_6:0_11:3)+HTG 6:0_11:3_16:1ME547768---589.4462665
TG(18:0_6:0_11:3)+NH4TG 6:0_11:3_18:0ME547821---636.5197655
TG(6:0_11:3_18:1)+HTG 6:0_11:3_18:1ME547978---617.4775665
TG(6:0_11:3_18:1)+NH4TG 6:0_11:3_18:1ME547979---634.5041155
TG(6:0_11:3_18:2)+HTG 6:0_11:3_18:2ME547980---615.4619165
TG(6:0_11:3_18:3)+HTG 6:0_11:3_18:3ME547981---613.4462665
TG(6:0_12:0_18:3)+NH4TG 6:0_12:0_18:3ME547982---650.5354155
TG(6:0_12:1_18:1)+NH4TG 6:0_12:1_18:1ME547983---652.5510655
TG(20:1_6:0_12:1)+NH4TG 6:0_12:1_20:1ME547955---680.5823655
TG(16:0_6:0_12:2)+HTG 6:0_12:2_16:0ME547712---607.4932165
TG(16:0_6:0_12:2)+NH4TG 6:0_12:2_16:0ME547713---624.5197655
TG(16:1_6:0_12:2)+HTG 6:0_12:2_16:1ME547769---605.4775665
TG(6:0_12:2_18:1)+HTG 6:0_12:2_18:1ME547984---633.5088665
TG(6:0_12:2_18:1)+NH4TG 6:0_12:2_18:1ME547985---650.5354155
TG(6:0_12:2_18:2)+HTG 6:0_12:2_18:2ME547986---631.4932165
TG(6:0_12:2_18:3)+HTG 6:0_12:2_18:3ME547987---629.4775665
TG(20:1_6:0_12:2)+NH4TG 6:0_12:2_20:1ME547956---678.5667155
TG(15:0_6:0_12:3)+NaTG 6:0_12:3_15:0ME547628---613.4438615
TG(6:0_14:0_18:3)+NH4TG 6:0_14:0_18:3ME547988---678.5667155
TG(6:0_14:1_18:1)+NH4TG 6:0_14:1_18:1ME547989---680.5823655
TG(6:0_18:1_18:1)+NaTG 6:0_18:1_18:1ME547990---741.6003615
TG(27:0_6:0_18:1)+NH4TG 6:0_18:1_27:0ME547965---864.8014655
TG(6:0_6:0_11:3)+HTG 6:0_6:0_11:3ME547991---451.3054165
TG(6:0_6:0_18:3)+HTG 6:0_6:0_18:3ME547992---549.4149665
TG(19:1_6:0_6:0)+NaTG 6:0_6:0_19:1ME547940---589.4438615
TG(6:0_6:0_21:0)+NH4TG 6:0_6:0_21:0ME547993---614.5354155
TG(6:0_6:0_21:1)+HTG 6:0_6:0_21:1ME547994---595.4932165
TG(6:0_6:0_21:1)+NH4TG 6:0_6:0_21:1ME547995---612.5197655
TG(16:0_6:0_9:0)+NH4TG 6:0_9:0_16:0ME547714---586.5041155
TG(16:1_6:0_9:0)+NH4TG 6:0_9:0_16:1ME547770---584.4884655
TG(6:0_9:0_18:1)+HTG 6:0_9:0_18:1ME547996---595.4932165
TG(6:0_9:0_18:1)+NH4TG 6:0_9:0_18:1ME547997---612.5197655
TG(6:0_9:0_18:2)+NH4TG 6:0_9:0_18:2ME547998---610.5041155
TG(18:4_6:0_9:0)+HTG 6:0_9:0_18:4ME547930---589.4462665
TG(6:0_9:0_20:3)+NH4TG 6:0_9:0_20:3ME547999---636.5197655
TG(16:0_8:0_10:0)+NH4TG 8:0_10:0_16:0ME547715---628.5510655
TG(8:0_10:1_11:3)+HTG 8:0_10:1_11:3ME548000---533.3836665
TG(8:0_10:1_18:1)+HTG 8:0_10:1_18:1ME548001---635.5245165
TG(8:0_10:1_18:1)+NH4TG 8:0_10:1_18:1ME548002---652.5510655
TG(16:0_8:0_10:2)+HTG 8:0_10:2_16:0ME547716---607.4932165
TG(8:0_10:2_18:2)+HTG 8:0_10:2_18:2ME548003---631.4932165
TG(8:0_12:2_18:2)+NH4TG 8:0_12:2_18:2ME548004---676.5510655
TG(16:1_8:0_14:1)+NH4TG 8:0_14:1_16:1ME547771---680.5823655
TG(16:0_8:0_18:1)+NH4TG 8:0_16:0_18:1ME547717---738.6606155
TG(8:0_18:1_18:2)+NH4TG 8:0_18:1_18:2ME548005---762.6606155
TG(16:0_9:0_9:0)+NH4TG 9:0_9:0_16:0ME547718---628.5510655
TG(16:1_9:0_9:0)+NH4TG 9:0_9:0_16:1ME547772---626.5354155
TG(9:0_9:0_18:1)+NH4TG 9:0_9:0_18:1ME548006---654.5667155
TG(12:0e_9:0_10:1)+HTG O-12:0_9:0_10:1*ME547586---553.4826515
TG(12:1e_12:4_20:0)+HTG O-12:1_12:4_20:0*ME547587---727.6235015
TG(12:1e_12:4_21:0)+HTG O-12:1_12:4_21:0*ME547588---741.6391515
TG(12:1e_6:0_18:2)+HTG O-12:1_6:0_18:2*ME547589---619.5296015
TG(12:1e_6:0_18:3)+HTG O-12:1_6:0_18:3ME547590---617.5139515
TG(12:1e_9:0_10:1)+HTG O-12:1_9:0_10:1*ME547591---551.4670015
TG(14:0e_9:0_10:1)+HTG O-14:0_9:0_10:1*ME547593---581.5139515
TG(14:1e_11:4_20:0)+HTG O-14:1_11:4_20:0*ME547594---741.6391515
TG(14:1e_12:4_19:0)+HTG O-14:1_12:4_19:0*ME547595---741.6391515
TG(14:1e_18:1_18:1)+NH4TG O-14:1_18:1_18:1*ME547596---832.7752505
TG(14:1e_8:0_11:3)+HTG O-14:1_8:0_11:3*ME547597---575.4670015
TG(14:1e_9:0_10:1)+HTG O-14:1_9:0_10:1*ME547598---579.4983015
TG(16:0e_10:3_12:2)+HTG O-16:0_10:3_12:2*ME547719---643.5296015
TG(16:0e_10:3_18:2)+HTG O-16:0_10:3_18:2*ME547720---727.6235015
TG(16:0e_14:0_16:0)+NH4TG O-16:0_14:0_16:0ME547721---782.7596005
TG(16:0e_14:0_18:2)+NH4TG O-16:0_14:0_18:2*ME547722---806.7596005
TG(16:0e_16:0_18:1)+HTG O-16:0_16:0_18:1ME547723---819.7800015
TG(16:0e_16:0_18:1)+NH4TG O-16:0_16:0_18:1ME547724---836.8065505
TG(16:0e_16:0_22:4)+NH4TG O-16:0_16:0_22:4*ME547725---886.8222005
TG(16:0e_16:0_22:5)+NH4TG O-16:0_16:0_22:5*ME547726---884.8065505
TG(16:0e_16:1_18:1)+NH4TG O-16:0_16:1_18:1ME547727---834.7909005
TG(16:0e_18:1_22:5)+NH4TG O-16:0_18:1_22:5ME547728---910.8222005
TG(16:0e_18:2_22:5)+NH4TG O-16:0_18:2_22:5*ME547729---908.8065505
TG(16:1e_14:0_16:0)+NH4TG O-16:1_14:0_16:0*ME547773---780.7439505
TG(16:1e_18:1_18:1)+NH4TG O-16:1_18:1_18:1*ME547774---860.8065505
TG(16:1e_18:2_18:2)+NH4TG O-16:1_18:2_18:2*ME547775---856.7752505
TG(16:1e_6:0_11:4)+HTG O-16:1_6:0_11:4*ME547776---573.4513515
TG(16:2e_6:0_11:3)+HTG O-16:2_6:0_11:3*ME547777---573.4513515
TG(18:0e_14:0_16:0)+NH4TG O-18:0_14:0_16:0*ME547822---810.7909005
TG(18:0e_16:0_18:1)+NH4TG O-18:0_16:0_18:1ME547823---864.8378505
TG(18:0e_16:0_22:4)+NH4TG O-18:0_16:0_22:4*ME547824---914.8535005
TG(18:0e_16:0_22:5)+NH4TG O-18:0_16:0_22:5*ME547825---912.8378505
TG(18:0e_18:1_18:1)+NH4TG O-18:0_18:1_18:1ME547826---890.8535005
TG(18:0e_18:1_22:4)+NH4TG O-18:0_18:1_22:4*ME547827---940.8691505
TG(18:0e_18:1_22:5)+NH4TG O-18:0_18:1_22:5*ME547828---938.8535005
TG(18:0e_18:2_22:5)+NH4TG O-18:0_18:2_22:5*ME547829---936.8378505
TG(18:1e_14:0_16:0)+NH4TG O-18:1_14:0_16:0*ME547906---808.7752505
TG(18:1e_16:0_17:0)+NH4TG O-18:1_16:0_17:0*ME547907---850.8222005
TG(18:1e_16:0_18:1)+NH4TG O-18:1_16:0_18:1ME547908---862.8222005
TG(18:1e_16:1_18:1)+NH4TG O-18:1_16:1_18:1*ME547909---860.8065505
TG(18:1e_16:1_18:2)+NH4TG O-18:1_16:1_18:2*ME547910---858.7909005
TG(18:1e_18:1_18:1)+NH4TG O-18:1_18:1_18:1ME547911---888.8378505
TG(18:1e_18:1_18:2)+NH4TG O-18:1_18:1_18:2*ME547912---886.8222005
TG(18:1e_18:2_20:4)+HTG O-18:1_18:2_20:4*ME547913---891.7800015
TG(20:1e_15:0_16:0)+NH4TG O-20:1_15:0_16:0*ME547957---850.8222005
TG(20:4e_11:3_19:0)+HTG O-20:4_11:3_19:0*ME547958---807.6861015
TG(20:4e_14:4_21:1)+HTG O-20:4_14:4_21:1*ME547959---873.7330515
TG(20:4e_6:0_18:1)+HTG O-20:4_6:0_18:1*ME547960---727.6235015
Hex3Cer(t18:0_22:0)+H-H2O-ME547454---1108.771745


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Cer(d12:0_18:1)+HCOOCer 12:0;O2/18:1ME548007---526.4476975
Cer(d13:0_22:0)+HCOOCer 13:0;O2/22:0ME548008---598.5415975
Cer(d14:2_22:0)+HCOOCer 14:2;O2/22:0ME548009---608.5259475
Cer(d15:0_20:2)+HCOOCer 15:0;O2/20:2ME548010---594.5102975
Cer(d15:0_22:1)+HCOOCer 15:0;O2/22:1ME548011---624.5572475
Cer(d15:0_26:3)+HCOOCer 15:0;O2/26:3ME548012---676.5885475
Cer(d16:1_16:0)+HCOOCer 16:1;O2/16:0ME548013---554.4789975
Cer(d16:1_16:1)+HCOOCer 16:1;O2/16:1ME548014---552.4633475
Cer(d16:1_18:1)+HCOOCer 16:1;O2/18:1ME548015---580.4946475
Cer(d16:1_24:2)+HCOOCer 16:1;O2/24:2ME548016---662.5728975
Cer(t16:1_16:1)+HCOOCer 16:1;O3/16:1ME548064---568.4582625
Cer(t16:1_23:0)+HCOOCer 16:1;O3/23:0ME548065---668.5834625
Cer(t16:1_24:1)+HCOOCer 16:1;O3/24:1ME548066---680.5834625
Cer(t16:1_26:2)+HCOOCer 16:1;O3/26:2ME548067---706.5991125
Cer(d16:2_22:0)+HCOOCer 16:2;O2/22:0ME548017---636.5572475
Cer(d16:2_22:0+O)+HCOOCer 16:2;O2/22:0;OME548018---652.5521625
Cer(d17:0_18:1)+HCOOCer 17:0;O2/18:1ME548019---596.5259475
Cer(t17:0_15:0+O)+HCOOCer 17:0;O3/15:0;OME548068---588.4844775
Cer(t17:0_16:0)+HCOOCer 17:0;O3/16:0ME548069---586.5052125
Cer(t17:0_17:0+O)+HCOOCer 17:0;O3/17:0;OME548070---616.5157775
Cer(t17:0_19:1)+HCOOCer 17:0;O3/19:1ME548071---626.5365125
Cer(t17:0_24:0+O)+HCOOCer 17:0;O3/24:0;OME548072---714.6253275
Cer(t17:0_25:0+O)+HCOOCer 17:0;O3/25:0;OME548073---728.6409775
Cer(d17:1_14:0)+HCOOCer 17:1;O2/14:0ME548020---540.4633475
Cer(d17:1_16:0)+HCOOCer 17:1;O2/16:0ME548021---568.4946475
Cer(d17:1_22:0)+HCOOCer 17:1;O2/22:0ME548022---652.5885475
Cer(d17:1_24:1)+HCOOCer 17:1;O2/24:1ME548023---678.6041975
Cer(m17:1_25:0)+HCOOCer 17:1;O/25:0ME548063---678.6405825
Cer(t17:1_15:0)+HCOOCer 17:1;O3/15:0ME548074---570.4739125
Cer(t17:1_16:1)+HCOOCer 17:1;O3/16:1ME548075---582.4739125
Cer(t17:1_18:1)+HCOOCer 17:1;O3/18:1ME548076---610.5052125
Cer(t17:1_23:0+O)+HCOOCer 17:1;O3/23:0;OME548077---698.5940275
Cer(t17:1_24:1)+HCOOCer 17:1;O3/24:1ME548078---694.5991125
Cer(t17:1_25:0+O)+HCOOCer 17:1;O3/25:0;OME548079---726.6253275
Cer(d18:0_16:0)+HCOOCer 18:0;O2/16:0ME548024---584.5259475
Cer(d18:0_24:0)+HCOOCer 18:0;O2/24:0ME548025---696.6511475
Cer(d18:0_24:1)+HCOOCer 18:0;O2/24:1ME548026---694.6354975
Cer(t18:0_16:0)+HCOOCer 18:0;O3/16:0ME548080---600.5208625
Cer(t18:0_18:0+O)+HCOOCer 18:0;O3/18:0;OME548081---644.5470775
Cer(t18:0_18:1)+HCOOCer 18:0;O3/18:1ME548082---626.5365125
Cer(t18:0_20:0)+HCOOCer 18:0;O3/20:0ME548083---656.5834625
Cer(t18:0_20:0+O)+HCOOCer 18:0;O3/20:0;OME548084---672.5783775
Cer(t18:0_22:0)+HCOOCer 18:0;O3/22:0ME548085---684.6147625
Cer(t18:0_23:0)+HCOOCer 18:0;O3/23:0ME548086---698.6304125
Cer(t18:0_24:0)+HCOOCer 18:0;O3/24:0ME548087---712.6460625
Cer(t18:0_24:1)+HCOOCer 18:0;O3/24:1ME548088---710.6304125
Cer(t18:0_24:2)+HCOOCer 18:0;O3/24:2ME548089---708.6147625
Cer(t18:0_25:0)+HCOOCer 18:0;O3/25:0ME548090---726.6617125
Cer(t18:0_25:0+O)+HCOOCer 18:0;O3/25:0;OME548091---742.6566275
Cer(t18:0_26:0)+HCOOCer 18:0;O3/26:0ME548092---740.6773625
Cer(t18:0_26:0+O)+HCOOCer 18:0;O3/26:0;OME548093---756.6722775
Cer(d18:1_16:0)-HCer 18:1;O2/16:0ME548028---536.5048175
Cer(d18:1_16:0)+HCOOCer 18:1;O2/16:0ME548027---582.5102975
Cer(d18:1_17:0)+HCOOCer 18:1;O2/17:0ME548029---596.5259475
Cer(d18:1_17:0+O)+HCOOCer 18:1;O2/17:0;OME548030---612.5208625
Cer(d18:1_18:0)+HCOOCer 18:1;O2/18:0ME548031---610.5415975
Cer(d18:1_18:1)+HCOOCer 18:1;O2/18:1ME548032---608.5259475
Cer(d18:1_18:2)+HCOOCer 18:1;O2/18:2ME548033---606.5102975
Cer(d18:1_20:0)+HCOOCer 18:1;O2/20:0ME548034---638.5728975
Cer(d18:1_22:0)-HCer 18:1;O2/22:0ME548036---620.5987175
Cer(d18:1_22:0)+HCOOCer 18:1;O2/22:0ME548035---666.6041975
Cer(d18:1_23:0)+HCOOCer 18:1;O2/23:0ME548037---680.6198475
Cer(d18:1_24:0)-HCer 18:1;O2/24:0ME548039---648.6300175
Cer(d18:1_24:0)+HCOOCer 18:1;O2/24:0ME548038---694.6354975
Cer(d18:1_24:1)-HCer 18:1;O2/24:1ME548041---646.6143675
Cer(d18:1_24:1)+HCOOCer 18:1;O2/24:1ME548040---692.6198475
Cer(d18:1_24:2)+HCOOCer 18:1;O2/24:2ME548042---690.6041975
Cer(d18:1_25:0)+HCOOCer 18:1;O2/25:0ME548043---708.6511475
Cer(d18:1_26:0)+HCOOCer 18:1;O2/26:0ME548044---722.6667975
Cer(d18:1_26:1)+HCOOCer 18:1;O2/26:1ME548045---720.6511475
Cer(d18:1_26:2)+HCOOCer 18:1;O2/26:2ME548046---718.6354975
Cer(t18:1_14:0)+HCOOCer 18:1;O3/14:0ME548094---570.4739125
Cer(t18:1_15:0)+HCOOCer 18:1;O3/15:0ME548095---584.4895625
Cer(t18:1_16:0)+HCOOCer 18:1;O3/16:0ME548096---598.5052125
Cer(t18:1_22:0)+HCOOCer 18:1;O3/22:0ME548097---682.5991125
Cer(t18:1_24:1)+HCOOCer 18:1;O3/24:1ME548098---708.6147625
Cer(t18:1_26:0)+HCOOCer 18:1;O3/26:0ME548099---738.6617125
Cer(t18:1_26:0+O)+HCOOCer 18:1;O3/26:0;OME548100---754.6566275
Cer(d18:2_16:0)+HCOOCer 18:2;O2/16:0ME548047---580.4946475
Cer(d18:2_18:0)-HCer 18:2;O2/18:0ME548048---562.5204675
Cer(d18:2_18:2)+HCOOCer 18:2;O2/18:2ME548049---604.4946475
Cer(d18:2_20:0)+HCOOCer 18:2;O2/20:0ME548050---636.5572475
Cer(d18:2_21:0)+HCOOCer 18:2;O2/21:0ME548051---650.5728975
Cer(d18:2_22:0)+HCOOCer 18:2;O2/22:0ME548052---664.5885475
Cer(d18:2_23:0)+HCOOCer 18:2;O2/23:0ME548053---678.6041975
Cer(d18:2_24:2)+HCOOCer 18:2;O2/24:2ME548054---688.5885475
Cer(d19:1_18:0)+HCOOCer 19:1;O2/18:0ME548055---624.5572475
Cer(d19:1_24:0)+HCOOCer 19:1;O2/24:0ME548056---708.6511475
Cer(d19:1_24:1)+HCOOCer 19:1;O2/24:1ME548057---706.6354975
Cer(d20:0_21:0)+HCOOCer 20:0;O2/21:0ME548058---682.6354975
Cer(d20:0_25:0)+HCOOCer 20:0;O2/25:0ME548059---738.6980975
Cer(t20:0_16:0)+HCOOCer 20:0;O3/16:0ME548101---628.5521625
Cer(t20:0_25:0)+HCOOCer 20:0;O3/25:0ME548102---754.6930125
Cer(t20:0_26:0)+HCOOCer 20:0;O3/26:0ME548103---768.7086625
Cer(t20:1_17:0)+HCOOCer 20:1;O3/17:0ME548104---640.5521625
Cer(d22:0_24:1)+HCOOCer 22:0;O2/24:1ME548060---750.6980975
Cer(d24:0_17:0)+HCOOCer 24:0;O2/17:0ME548061---682.6354975
Cer(d24:2_18:1)+HCOOCer 24:2;O2/18:1ME548062---690.6041975
Hex2Cer(d16:0_18:1)+HCOOHex2Cer 16:0;O2/18:1ME548110---906.6159475
Hex2Cer(d18:1_24:0)+HCOOHex2Cer 18:1;O2/24:0ME548111---1018.741148
Hex2Cer(d18:1_24:1)+HCOOHex2Cer 18:1;O2/24:1ME548112---1016.725498
Hex1Cer(d18:1_16:0)+HCOOHexCer 18:1;O2/16:0ME548105---744.5631225
Hex1Cer(d18:1_22:0)+HCOOHexCer 18:1;O2/22:0ME548106---828.6570225
Hex1Cer(d18:1_23:0)+HCOOHexCer 18:1;O2/23:0ME548107---842.6726725
Hex1Cer(d18:1_24:0)+HCOOHexCer 18:1;O2/24:0ME548108---856.6883225
Hex1Cer(d18:1_24:1)+HCOOHexCer 18:1;O2/24:1ME548109---854.6726725
LPC(14:0)+HCOOLPC 14:0ME548113---512.2993955
LPC(15:0)+HCOOLPC 15:0ME548114---526.3150455
LPC(16:0)-CH3LPC 16:0ME548116---480.3095655
LPC(16:0)+HCOOLPC 16:0ME548115---540.3306955
LPC(16:1)+HCOOLPC 16:1ME548117---538.3150455
LPC(17:0)+HCOOLPC 17:0ME548118---554.3463455
LPC(18:0)+HCOOLPC 18:0ME548119---568.3619955
LPC(18:1)+HCOOLPC 18:1ME548120---566.3463455
LPC(18:2)+HCOOLPC 18:2ME548121---564.3306955
LPC(19:0)+HCOOLPC 19:0ME548122---582.3776455
LPC(20:4)+HCOOLPC 20:4ME548123---588.3306955
LPE(16:0)-HLPE 16:0ME548124---452.2782655
LPE(18:0)-HLPE 18:0ME548126---480.3095655
LPE(18:1)-HLPE 18:1ME548127---478.2939155
LPE(18:2)-HLPE 18:2ME548129---476.2782655
LPE(16:1e)-HLPE O-16:1ME548125---436.2833505
LPE(18:1e)-HLPE O-18:1ME548128---464.3146505
LPE(18:2e)-HLPE O-18:2ME548130---462.2990005
LPI(18:0)-HLPI 18:0ME548131---599.3201915
LPS(18:0)-HLPS 18:0ME548132---524.2993955
PC(16:0_14:0)+HCOOPC 14:0_16:0ME548133---750.5290605
PC(16:1_14:0)-CH3PC 14:0_16:1ME548139---688.4922805
PC(16:0_16:0)+HCOOPC 16:0/16:0ME548134---778.5603605
PC(16:0_16:1)+HCOOPC 16:0_16:1ME548135---776.5447105
PC(18:0_16:0)+HCOOPC 16:0_18:0ME548143---806.5916605
PC(16:0_18:1)+HCOOPC 16:0_18:1ME548136---804.5760105
PC(16:0_18:2)+HCOOPC 16:0_18:2ME548137---802.5603605
PC(16:0_20:4)+HCOOPC 16:0_20:4ME548138---826.5603605
PC(16:1_18:2)+HCOOPC 16:1_18:2ME548140---800.5447105
PC(18:0_18:1)+HCOOPC 18:0_18:1ME548144---832.6073105
PC(18:0_18:2)+HCOOPC 18:0_18:2ME548145---830.5916605
PC(18:0_20:4)+HCOOPC 18:0_20:4ME548146---854.5916605
PC(18:1_18:1)+HCOOPC 18:1/18:1ME548147---830.5916605
PC(18:1_18:2)+HCOOPC 18:1_18:2ME548148---828.5760105
PC(19:1_18:1)-CH3PC 18:1_19:1ME548152---784.5861805
PC(19:1_18:1)+HCOOPC 18:1_19:1ME548151---844.6073105
PC(18:2_18:2)+HCOOPC 18:2/18:2ME548150---826.5603605
PC(19:1_19:1)+HCOOPC 19:1/19:1ME548153---858.6229605
PC(16:1e_16:0)+HCOOPC O-16:1/16:0ME548141---762.5654455
PC(16:1e_20:4)+HCOOPC O-16:1/20:4ME548142---810.5654455
PC(18:1e_16:0)+HCOOPC O-18:1/16:0ME548149---790.5967455
PE(16:1_14:0)-HPE 14:0_16:1ME548160---660.4609805
PE(15:0_16:0)-HPE 15:0_16:0ME548154---676.4922805
PE(17:1_15:0)-HPE 15:0_17:1ME548165---688.4922805
PE(15:0_18:1)-HPE 15:0_18:1ME548155---702.5079305
PE(16:0_16:0)-HPE 16:0/16:0ME548156---690.5079305
PE(16:0_16:1)-HPE 16:0_16:1ME548157---688.4922805
PE(17:1_16:0)-HPE 16:0_17:1ME548166---702.5079305
PE(16:0_18:1)-HPE 16:0_18:1ME548158---716.5235805
PE(16:0_19:0)-HPE 16:0_19:0ME548159---732.5548805
PE(19:1_16:0)-HPE 16:0_19:1ME548172---730.5392305
PE(16:1_16:1)-HPE 16:1/16:1ME548161---686.4766305
PE(16:1_18:1)-HPE 16:1_18:1ME548162---714.5079305
PE(16:1_19:0)-HPE 16:1_19:0ME548163---730.5392305
PE(18:0_18:1)-HPE 18:0_18:1ME548167---744.5548805
PE(18:0_20:4)-HPE 18:0_20:4ME548168---766.5392305
PE(18:1_18:1)-HPE 18:1/18:1ME548169---742.5392305
PE(19:1_18:1)-HPE 18:1_19:1ME548173---756.5548805
PE(18:2_18:2)-HPE 18:2/18:2ME548171---738.5079305
PE(19:1_19:1)-HPE 19:1/19:1ME548174---770.5705305
PE(19:1_20:1)-HPE 19:1_20:1ME548175---784.5861805
PE(16:1e_20:4)-HPE O-16:1/20:4ME548164---722.5130155
PE(18:1e_20:4)-HPE O-18:1/20:4ME548170---750.5443155
PG(15:0_15:0)-HPG 15:0/15:0ME548176---693.4712115
PG(15:0_16:0)-HPG 15:0_16:0ME548177---707.4868615
PG(15:0_17:0)-HPG 15:0_17:0ME548178---721.5025115
PG(16:0_16:0)-HPG 16:0/16:0ME548179---721.5025115
PG(16:0_16:1)-HPG 16:0_16:1ME548180---719.4868615
PG(17:1_16:0)-HPG 16:0_17:1ME548182---733.5025115
PG(16:0_18:1)-HPG 16:0_18:1ME548181---747.5181615
PG(18:0_18:1)-HPG 18:0_18:1ME548183---775.5494615
PG(18:1_18:1)-HPG 18:1/18:1ME548184---773.5338115
PG(19:1_18:1)-HPG 18:1_19:1ME548185---787.5494615
PI(16:0_16:0)-HPI 16:0/16:0ME548186---809.5185565
PI(16:0_17:0)-HPI 16:0_17:0ME548187---823.5342065
PI(16:0_18:1)-HPI 16:0_18:1ME548188---835.5342065
PI(16:0_19:0)-HPI 16:0_19:0ME548189---851.5655065
PI(17:0_17:0)-HPI 17:0/17:0ME548190---837.5498565
PI(18:0_20:4)-HPI 18:0_20:4ME548191---885.5498565
PS(18:0_18:1)-HPS 18:0_18:1ME548192---788.5447105


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