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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
1-(beta-D-Ribofuranosyl)-1,4-dihydronicotinamide1-(beta-D-Ribofuranosyl)-1,4-dihydronicotinamideME911126--3.9257.1149
1-Methyladenosine1-MethyladenosineME911146--2.29282.1196
1-Methylguanine1-MethylguanineME911151--2.38166.0719
1-Methylhistidine1-MethylhistidineME911073--1.29170.0932
1-methylnicotinamide1-Methyl nicotinamideME911155--1.09173.0478
2-Acetylpyrazine2-AcetylpyrazineME911142--2.14123.055
2-Aminobenzoic acid2-Aminobenzoic acidME911124--5.86138.0545
2-Deoxygalactopyranose-ME911127--1.54165.0708
2-Methylnicotinamide-ME911156--8.17137.0703
2-Piperidinone2-PiperidinoneME911144--4.44100.0754
3-methyl-2-Quinoxalinone-ME911169--8.16161.0717
4-Hydroxyprolinecis-4-HydroxyprolineME911117--1.37132.0611
4-Trimethylammoniobutanoic acid3-DehydroxycarnitineME911130--4.89146.1172
5'-Methylthioadenosine5'-MethylthioadenosineME911140--4.77298.0969
AcetylcholineAcetylcholineME911165--1.5146.1174
AdenosineAdenosineME911147--3.69268.1043
AllopurinolAllopurinolME911152--3.82137.0447
BetaineBetaineME911074--1.41118.0855
ButyrylcarnitineCAR 4:0ME911062--4.72232.154
CDP-ethanolamineCDP-EthanolamineME911160--1.42447.0676
CholineCholineME911166--1.32104.1066
CitrullineCitrullineME911075--1.42176.1026
CreatineCreatineME911076--1.51132.0742
CreatinineCreatinineME911077--1.49114.0647
CytidineCytidineME911159--1.92244.0907
CytosineCytosineME911161--1.91112.0497
D-Fructofuranose 1,2':2,3'-dianhydride-ME911128--1.57325.1125
Dihydroactinidiolide-ME911123--9.56181.1218
DL-2-Aminooctanoic acid2-Aminocaprylic acidME911078--5.73160.1328
DodecanoylcarnitineCAR 12:0ME911063--1.37153.0901
gamma-Aminobutyric acidgamma-Aminobutyric acidME911080--9.18344.2805
GlutathioneGlutathioneME911120--1.33104.0691
Glycerophosphocholinesn-Glycero-3-phosphocholineME911131--1.36258.1094
GlycineGlycineME911081--1.3176.0386
GuanineGuanineME911153--3.77152.0564
Guanosine monophosphateGMPME911150--2.13364.0642
Hippuric acidHippuric acidME911125--5.87180.0649
HypoxanthineHypoxanthineME911154--2.42137.0445
IsobutyrylcarnitineCAR 3:0;2MeME911064--4.64232.1537
IsovalerylcarnitineCAR 4:0;3MeME911065--5.35246.1713
IsovalerylglycineIsovalerylglycineME911082--1.47160.0964
L-2-Amino-4-methylenepentanedioic acid-ME911083--1.57160.0607
L-AcetylcarnitineCAR 2:0ME911066--2.27204.1233
L-AlanineAlanineME911084--1.3690.0543
L-ArginineArginineME911085--1.29175.1179
L-AsparagineAsparagineME911086--1.32133.0594
L-Aspartic acidAspartic acidME911087--1.32134.0448
L-CarnitineCarnitineME911167--1.38162.1111
L-CystathionineCystathionineME911118--1.37223.0738
L-CysteineCysteineME911119--1.44122.0271
Leucyl-AspartateLeu-AspME911088--4.2247.1277
LeucylprolineLeu-ProME911089--2.36229.1541
L-gamma-glutamyl-L-isoleucinegamma-GlutamylisoleucineME911090--4.8261.1436
L-gamma-glutamyl-L-leucinegamma-GlutamylleucineME911091--5261.1436
L-Glutamic acidGlutamic acidME911079--1.41148.0606
L-GlutamineGlutamineME911092--1.32147.0765
L-HistidineHistidineME911093--1.29156.0762
L-homocysteineHomocysteineME911121--1.69136.0426
L-IsoleucineIsoleucineME911094--3.38132.1019
L-KynurenineKynurenineME911143--4.34209.0919
L-LeucineLeucineME911095--3.64132.1012
L-LysineLysineME911096--1.18147.1125
L-MethionineMethionineME911097--2.27150.0578
L-PhenylalaninePhenylalanineME911098--4.34166.0856
L-ProlineProlineME911099--1.54116.0706
L-ThreonineThreonineME911100--1.37120.0649
L-TryptophanTryptophanME911101--4.95205.0957
L-TyrosineTyrosineME911102--3.57182.0809
LumichromeLumichromeME911145--7.08243.0882
L-ValineValineME911103--1.92118.0855
LysoPC(14:0)LPC 14:0ME911132--10.33468.308
LysoPC(16:0)LPC 16:0ME911133--11.69497.3435
LysoPC(P-16:0/0:0)LPC P-16:0ME911134--12.11480.3433
LysoPE(16:0)LPE 16:0ME911136--11.62454.2916
LysoPE(18:1)LPE 18:1ME911137--11.95480.3054
LysoPE(18:2)LPE 18:2ME911138--11.07478.2915
MethacholineMethacholineME911070--1.89160.1321
Methionine sulfoxideMethionine sulfoxideME911104--1.41166.0525
N1-Methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME911157--3.88153.0653
N2-AcetylornithineN-AcetylornithineME911105--1.62175.1071
N2,N2-DimethylguanosineN2,N2-DimethylguanosineME911148--4.39312.1289
N6,N6,N6-Trimethyl-L-lysineN-6-TrimethyllysineME911106--1.31189.1341
N-AcetylglutamineN-AcetylglutamineME911072--1.54189.087
NiacinamideNiacinamideME911158--2.31123.0553
OrnithineOrnithineME911107--1.17133.0964
Pantothenic acidPantothenic acidME911071--4.5220.1181
PC (16:0)PC 16:0ME911135--12.14482.3585
Phenacemide-ME911122--8.17179.0805
PhenylalanylphenylalaninePhe-PheME911108--6.18313.1537
PhosphorylcholineCholine phosphateME911168--1.34184.0724
Pipecolic acidPipecolic acidME911109--2.16130.085
PivaloylcarnitineCAR 3:0;Me2ME911067--5.47246.1705
Proline betaineProline betaineME911110--1.59144.1006
ProlylhydroxyprolinePro-hydroxyProME911111--1.69229.1173
PropionylcarnitineCAR 3:0ME911068--3.87218.1376
Pyroglutamic acidPyroglutamic acidME911112--2.66130.0498
PyroglutaminePyroglutamineME911113--1.46129.0656
PyrrolidinePyrrolidineME911164--1.9472.0806
SAHS-AdenosylhomocysteineME911139--3.31385.1299
SAMS-AdenosylmethionineME911141--1.36399.1452
S-Methyl-L-cysteinesulfoxide-ME911114--1.33152.0313
SuccinyladenosineSuccinyladenosineME911149--4.37384.1149
Symmetric dimethylarginineSymmetric dimethylarginineME911115--1.49203.1517
TaurineTaurineME911116--1.33126.0214
ThymineThymineME911162--4127.0498
TrehaloseTrehaloseME911129--1.58343.1241
UracilUracilME911163--3.4113.0338
ValerylcarnitineCAR 5:0ME911069--5.47246.1701


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