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Analysis: HILIC NEGATIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
12(S)-HHT12S-HHTrEME908139----
1,4-Bis(2-ethylhexyl) sulfosuccinate-ME908147----
2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propa...-ME908132----
2-arachidonyl-sn-glycero-3-phosphoethanolamine-ME908117----
2L4RKM5351-ME908115----
3-Hydroxyoctanoic acid3-Hydroxyoctanoic acidME908146----
3-Methylbutanoic acidIsovaleric acidME908105----
5-Methoxy-3-indoleaceate-ME908123----
AcetanilideN-AcetylarylamineME908130----
Adenosine monophosphateAMPME908128----
AllantoinAllantoinME908084----
alpha-Glucoheptitol-ME908092----
Aminolevulinic acidAminolevulinic acidME908113----
AnserineAnserineME908141----
APMAla-Pro-MetME908148----
Arachidonic acidArachidonic acidME908136----
Benzoic acidBenzoic acidME908127----
beta-D-Galactopyranose-ME908119----
Butyl acetaten-Butyl acetateME908106----
(+/-)-Camphoric acid-ME908150----
CiticolineCDP-cholineME908107----
Corn thiazoline-ME908087----
Decanoic acidCapric acidME908110----
deoxyuridineDeoxyuridineME908090----
Diethyl malonate-ME908153----
Dimethyl maleateDimethyl maleateME908152----
DL-Lactic Acid-ME908122----
DL-PhenylalaninePhenylalanineME908099----
Docosahexaenoic acidDocosahexaenoic acidME908142----
(E)-Aconitic Acid-ME908124----
Eicosapentanoic acid-ME908149----
ErythritolErythritolME908103----
Ethyl eicosapentaenoic acid-ME908118----
FB9500000-ME908131----
fructosylglycine-ME908102----
Galacturonic acidGalacturonic acidME908138----
gamma-Glu-glngamma-GlutamylglutamineME908144----
Glutaric acidGlutaric acidME908145----
GlycineGlycineME908086----
guaiacol sulfateGuaiacol sulfateME908129----
Hippuric acidHippuric acidME908135----
Homo-L-arginineHomoarginineME908154----
Homovanillic acidHomovanillic acidME908108----
icomucret15S-HETEME908134----
L-(-)-AsparagineAsparagineME908097----
Levulinic acidLevulinic acidME908112----
L-(+)-glutamineGlutamineME908088----
(.+/-.)-Linalyl acetate-ME908120----
L-(-)-methionineMethionineME908143----
L-ProlineProlineME908111----
L-(-)-SerineSerineME908089----
L-Serine O-phosphate-ME908095----
L-(-)-ThreonineThreonineME908109----
Maleic acidMaleic acidME908101----
(±)-Malic AcidMalic acidME908098----
MFCD00070502-ME908133----
Myristoleic acidMyristoleic acidME908137----
N-Acetyl-DL-histidine-ME908116----
N-Acetyl-L-aspartic acidN-Acetylaspartic acidME908121----
n-heptanoic acidHeptylic acidME908114----
Palmitelaidic acidPalmitelaidic acidME908151----
p-Cresylsulfate-ME908126----
P-DMEAN,N-Dimethylethanolamine phosphateME908096----
pentadecanoic acidPentadecylic acidME908155----
SorbitolSorbitolME908104----
Succinic acidSuccinic acidME908085----
TaurineTaurineME908094----
threonic acidThreonic acidME908100----
ThymidineThymidineME908093----
ThymineThymineME908140----
UridineUridineME908125----
XanthineXanthineME908091----


Analysis: HILIC POSITIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
(10E,15Z)-9,12,13-Trihydroxy-10,15-octadecadienoic...-ME908265----
1,2-Dioleoyl-sn-glycero-3-PE-ME908261----
13Z,16Z-docosadienoic acid13Z,16Z-Docosadienoic acidME908216----
1-arachidonoyl-sn-glycero-3-phosphocholineLPC 20:4/0:0ME908292----
1D-myo-Inositol 1,2-cyclic phosphateInositol cyclic phosphateME908186----
1-hexadecyl-2-[(9Z,12Z)-octadecadienoyl]-sn-glycer...PC O-16:0/18:2(9Z,12Z)ME908247----
1-Octadecyl (2Z)-2-butenedioate-ME908187----
1-Oleoyl-2-Stearoyl-sn-Glycero-3-Phosphocholine-ME908255----
1-Oleoyl-rac-glycerolLPC 18:1ME908196----
1-(sn-glycero-3-phospho)-1D-myo-inositolsn-Glycero-3-phosphoinositolME908294----
1-Stearoyl-2-hydroxy-sn-glycero-3-PELPE 18:0/0:0ME908277----
2,4-Diamino-6-nitrotoluene-ME908240----
2,4-Diaminotoluene-ME908287----
2-Acetamidohexanedioic acid-ME908194----
2-Amino-3-(1H-imidazol-4-yl)propanalHistidinalME908173----
2-Aminoethyl (2R)-3-[(1Z)-1-hexadecen-1-yloxy]-2-h...-ME908273----
2-(Diethylamino)ethanol-ME908175----
2-Isobutyl-3-methoxypyrazine-ME908268----
2-Isopropyl-3-methoxypyrazine-ME908223----
2-methylbutyrylcarnitineCAR 4:0;2MeME908161----
[(2R,3R,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3-hydroxy...-ME908284----
3,7,15-Trihydroxy-12,13-epoxytrichothec-9-en-8-one-ME908245----
3-Hydroxy-5, 8-tetradecadiencarnitine-ME908201----
3-hydroxyhexadecanoylcarnitineCAR 16:0;3OHME908234----
3-Methylcyclopentene-ME908160----
3-Phenylpropanoic acidHydrocinnamic acidME908164----
4-Acetamido-2-amino-6-nitrotoluene-ME908290----
4-Oxo-O-phosphonohomoserine-ME908225----
5-methylthioribose5-MethylthioriboseME908177----
8-hydroxy-deoxyguanosine8-Hydroxy-deoxyguanosineME908274----
AcetylcarnitineCAR 2:0ME908272----
AcetylhistamineN-AcetylhistamineME908167----
ACPC-ME908171----
AdenineAdenineME908178----
AdenosineAdenosineME908259----
Adenylthiomethylpentose-ME908217----
ALA-PROAla-ProME908242----
.alpha.-Aminoadipic acidalpha-Aminoadipic acidME908163----
AmphetamineDextroamphetamineME908267----
asn-lysAsn-LysME908169----
asn-valAsn-ValME908257----
benzoquinoneQuinoneME908256----
BiacetylDiacetylME908220----
bilirubinBilirubinME908269----
C4-CarnitineCAR 4:0ME908211----
C8-CarnitineCAR 8:0ME908253----
carglumic acidCarglumic acidME908260----
carnosineCarnosineME908246----
CMP-Neu5AcCMP-N-acetylneuraminic acidME908191----
CreatineCreatineME908226----
CreatinineCreatinineME908158----
cuscohygrineCuscohygrineME908219----
CytosineCytosineME908185----
D-(-)-3-Phosphoglyceric acid3-Phosphoglyceric acidME908199----
DeanolDimethylethanolamineME908156----
DiethylamineDiethylamineME908170----
dimethylformamide-ME908190----
DL-CarnitineCarnitineME908168----
DL-CitrullineCitrullineME908197----
DL-Glutamic acidGlutamic acidME908180----
DL-HomocysteineHomocysteineME908202----
DL-LysineLysineME908166----
DL-OrnithineOrnithineME908206----
DOA-ME908248----
Dodecanedioic acidDodecanedioic acidME908192----
D-Sedoheptulose 7-phosphateSedoheptulose 7-phosphateME908231----
Epiguanine7-MethylguanineME908241----
EUGENOL ISOVALERATE-ME908285----
felbamateFelbamateME908189----
Formiminoglutamic AcidFormiminoglutamic acidME908289----
Fructose 1-phosphateFructose 1-phosphateME908209----
Furfural2-FurancarboxaldehydeME908239----
FZ7700000-ME908228----
gamma-Aminobutyric acidgamma-Aminobutyric acidME908221----
g-Butyrobetaine3-DehydroxycarnitineME908172----
GDP-alpha-D-mannoseGDP-mannoseME908218----
GlcNAc-6-P-ME908227----
glu-serGlu-SerME908288----
GlutarylcarnitineCAR DC5:0ME908251----
glu-thrGlu-ThrME908195----
glyceraldehyde 3-phosphateGlyceraldehyde 3-phosphateME908208----
Glyceryl phosphatesn-Glycero-3-phosphateME908230----
Guanidinosuccinic acidGuanidinosuccinic acidME908276----
GUDCAGlycoursodeoxycholic acidME908165----
HomoanserineHomoanserineME908207----
HomocitrullineHomocitrullineME908244----
Hypoxanthin-ME908243----
Indole-3-acetaldehydeIndoleacetaldehydeME908176----
Indoleacrylic acidIndoleacrylic acidME908224----
Inosinic acidIMPME908286----
KYNURAMINEKynuramineME908280----
L-alpha-lysophosphatidylcholine-ME908291----
L-(+)-Aspartic acidAspartic acidME908183----
Leu-proLeu-ProME908263----
L-HexanoylcarnitineCAR 6:0ME908182----
L-HistidineHistidineME908283----
linatineLinatineME908271----
L-(+)-ValineValineME908254----
lys-leuLys-LeuME908213----
Lyso-PAF C-18-ME908203----
LysoPC(20:5(5Z,8Z,11Z,14Z,17Z))LPC 20:5(5z,8z,11z,14z,17z)ME908250----
LysylvalineLys-ValME908258----
methionine S-oxideMethionine sulfoxideME908184----
Methylol Dimethylhydantoin-ME908200----
MFCD00036904-ME908232----
MFCD00065857-ME908281----
MFCD00133435-ME908235----
MFCD05863969-ME908198----
N(1)-acetylspermidineN1-AcetylspermidineME908157----
N-(1-Methyl-4-oxo-4,5-dihydro-1H-imidazol-2-yl)ala...-ME908275----
N4-(beta-N-Acetyl-D-glucosaminyl)-L-asparagineAspartylglycosamineME908270----
N6-METHYLLYSINEN(6)-MethyllysineME908233----
N6,N6,N6-Trimethyl-L-lysineN-6-TrimethyllysineME908222----
N-AcetylvalineN-AcetylvalineME908249----
NicotinamideNiacinamideME908210----
N,N-dimethylarginineDimethylarginineME908282----
NudifloramideN1-Methyl-2-pyridone-5-carboxamideME908179----
Octyl gallate-ME908215----
O-succinylcarnitineCAR DC4:0ME908205----
PC-ME908279----
PEG-4-ME908293----
Pentahomoserine-ME908188----
Phenazone-ME908174----
PhenethylaminePhenylethylamineME908252----
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME908236----
Platelet-activating factor-ME908214----
propionylcarnitineCAR 3:0ME908229----
putrescinePutrescineME908266----
PyridoxalPyridoxalME908262----
Pyrogallol1,2,3-TrihydroxybenzeneME908162----
S-Adenosyl-L-homocysteineS-AdenosylhomocysteineME908264----
Spaglumic acidN-Acetyl-Asp-GluME908212----
Spermic acid-ME908193----
(S,S)-2,6-diaminopimelic acid-ME908237----
theaspirane-ME908278----
TiglylcarnitineCAR 4:1;2MeME908238----
Trimethylamine N-oxideTrimethylamine N-oxideME908181----
Uridine monophosphateUMPME908159----
XanthosineXanthosineME908204----


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