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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
1-methyladenosine1-MethyladenosineME630401--7.66282.1182
1-methylguanosine1-MethylguanosineME630402--5.01298.1123
1-methylhistamine1-MethylhistamineME630403--9.6126.1024
1-methylnicotinamide1-Methyl nicotinamideME630404--8.22137.0703
21-deoxycortisol21-DeoxycortisolME630405--2.02347.2198
2'-deoxyadenosineDeoxyadenosineME630406--5.2252.1077
2'-deoxycytidineDeoxycytidineME630407--5.99228.096
3-methylhistidine3-MethylhistidineME630408--9.84170.0911
4-guanidinobutanoate4-Guanidinobutanoic acidME630409--7.25146.0916
5-hydroxytryptophol5-HydroxytryptopholME630410--1.83178.0847
5-methylcytidine5-MethylcytidineME630411--6.01258.1073
5-methylcytosine5-MethylcytosineME630412--6.1126.0658
7-methylguanine7-MethylguanineME630413--5.76166.0711
acetylcholineAcetylcholineME630414--7.73146.1169
acisogaAcisogaME630415--5.6185.1269
adenosineAdenosineME630416--5.01268.1027
ADMADimethylarginineME630417--9.75203.1484
agmatineAgmatineME630418--9.12131.1287
ala-alaAla-AlaME630419--8.05161.0909
alanineAlanineME630420--7.8190.0548
allantoinAllantoinME630421--3.65159.0502
alpha-glycerophosphocholinesn-Glycero-3-phosphocholineME630422--10.45258.1089
anserineAnserineME630423--10.5241.1279
arachidoyl ethanolamideEicosanoyl-EAME630424--1.99356.3504
arginineArginineME630425--9.14175.1175
asparagineAsparagineME630426--7.92133.0603
aspartateAspartic acidME630427--7.97134.0443
beta-alaninebeta-AlanineME630428--8.0390.0548
beta-guanidinopropionate3-Guanidinopropanoic acidME630429--7.48132.0763
betaineBetaineME630430--8.97118.0861
bilirubinBilirubinME630431--1.68585.2675
biliverdinBiliverdinME630432--1.99583.252
biopterinBiopterinME630433--5.17238.0918
butyrobetaine3-DehydroxycarnitineME630434--8.8146.1167
C10 carnitineCAR 10:0ME630448--7.09316.2464
C12:1 carnitineCAR 12:1ME630450--6.95342.2618
C12 carnitineCAR 12:0ME630449--6.89344.2774
C14:0 LPCLPC 14:0ME630562--7.83468.3063
C14:0 SMSM 18:1;O2/14:0ME630613--7.23675.5368
C14:1 carnitineCAR 14:1ME630452--6.74370.2931
C14:2 carnitineCAR 14:2ME630453--6.8368.2774
C14 carnitineCAR 14:0ME630451--6.74372.3086
C16:0 Ceramide (d18:1)Cer 18:1;O2/16:0ME630623--1.87538.5178
C16:0 LPCLPC 16:0ME630564--7.7496.3376
C16:0 LPELPE 16:0ME630581--6.27454.2907
C16:0 SMSM 18:1;O2/16:0ME630615--7.13703.5681
C16:1 LPCLPC 16:1ME630563--7.76494.3221
C16:1 LPC plasmalogenLPC P-16:1 or LPC O-16:2ME630578--7.52480.3429
C16:1 SMSM 18:1;O2/16:1ME630614--7.14701.5528
C16 carnitineCAR 16:0ME630454--6.62400.3398
C16-OH carnitineCAR 16:0;OHME630455--7.07416.3348
C18:0 LPCLPC 18:0ME630569--7.58524.3692
C18:0 LPE ALPE 18:0ME630585--6.2482.322
C18:0 LPE BLPE 18:0ME630586--7.77482.3222
C18:0 SMSM 18:1;O2/18:0ME630617--7.06731.6
C18:1 carnitineCAR 18:1ME630457--6.53426.3555
C18:1 LPC ALPC 18:1ME630567--7.64522.3537
C18:1 LPC BLPC 18:1ME630568--7.5522.3539
C18:1 LPC plasmalogen ALPC P-18:0 or LPC O-18:1ME630579--7.74508.3741
C18:1 LPC plasmalogen BLPC P-18:0 or LPC O-18:1ME630580--7.41508.3743
C18:1 LPELPE 18:1ME630584--6.22480.3064
C18:1-OH carnitineCAR 18:1;OHME630458--6.98442.3505
C18:1 SMSM 18:1;O2/18:1ME630616--7.07729.5845
C18:2 carnitineCAR 18:2ME630459--6.59424.3398
C18:2 LPCLPC 18:2ME630566--7.69520.3379
C18:2 LPELPE 18:2ME630583--6.25478.291
C18:3 LPCLPC 18:3ME630565--7.71518.3197
C18:3 LPELPE 18:3ME630582--6.27476.2733
C18 carnitineCAR 18:0ME630456--6.51428.3712
C20:0 LPELPE 20:0ME630588--7.64510.3534
C20:0 SMSM 18:1;O2/20:0ME630618--6.99759.6291
C20:1 LPCLPC 20:1ME630573--7.51550.3854
C20:3 LPCLPC 20:3ME630572--7.44546.3518
C20:4 carnitineCAR 20:4ME630461--6.48448.3397
C20:4 LPC ALPC 20:4ME630570--7.62544.3381
C20:4 LPC BLPC 20:4ME630571--7.48544.3383
C20:4 LPELPE 20:4ME630587--6.12502.2909
C20 carnitineCAR 20:0ME630460--6.41456.4026
C22:0 SMSM 18:1;O2/22:0ME630619--6.93787.6595
C22:4 LPCLPC 22:4ME630576--7.41572.3678
C22:5 LPCLPC 22:5ME630575--7.44570.3524
C22:6 LPCLPC 22:6ME630574--7.44568.3366
C22:6 LPELPE 22:6ME630589--6.09526.2911
C24:0 LPCLPC 24:0ME630577--7.26608.4621
C24:1 ceramide (d18:1)Cer 18:1;O2/24:1ME630624--1.81648.6242
C26 carnitineCAR 26:0ME630462--6.2540.4971
C2 carnitineCAR 2:0ME630437--8.7204.1213
C30:0 PCPC 30:0ME630590--6.64706.5321
C32:2 PCPC 32:2ME630591--6.6730.5326
C34:0 PEPE 34:0ME630600--6.62720.5482
C34:2 PEPE 34:2ME630599--5.49716.5164
C34:2 PE plasmalogenPE P-34:1 or PE O-34:2ME630607--5.44702.5368
C34:3 PCPC 34:3ME630592--6.64756.5437
C34:3 PC plasmalogenPC P-34:2 or PC O-34:3ME630594--6.51742.5685
C34:3 PE plasmalogenPE P-34:2 or PE O-34:3ME630606--5.44700.5211
C36:2 PCPC 36:2ME630593--6.52786.5923
C36:2 PEPE 36:2ME630602--5.46744.548
C36:3 PE plasmalogenPE P-36:2 or PE O-36:3ME630596--5.42728.5521
C36:4 PEPE 36:4ME630601--5.42740.5168
C36:5 PC plasmalogenPC P-36:4 or PC O-36:5ME630595--6.42766.5664
C36:5 PE plasmalogenPE P-36:4 or PE O-36:5ME630608--5.37724.5215
C38:4 PEPE 38:4ME630604--5.39768.5453
C38:5 PE plasmalogenPE P-38:4 or PE O-38:5ME630611--5.35752.5501
C38:6 PC plasmalogenPC P-38:5 or PC O-38:6ME630598--6.39792.5825
C38:6 PEPE 38:6ME630603--5.4764.5144
C38:6 PE plasmalogenPE P-38:5 or PE O-38:6ME630610--5.35750.5347
C38:7 PC plasmalogenPC P-38:6 or PC O-38:7ME630597--6.4790.5666
C38:7 PE plasmalogenPE P-38:6 or PE O-38:7ME630609--5.35748.5193
C3 carnitineCAR 3:0ME630438--8.33218.137
C3-DC carnitineCAR DC3:0ME630439--9.52248.1114
C3-DC-CH3 carnitineCAR 3:0;2MeME630440--8.62262.1275
C40:6 PEPE 40:6ME630605--5.37792.5456
C40:7 PE plasmalogenPE P-40:6 or PE O-40:7ME630612--5.32776.5506
C4 carnitineCAR 4:0ME630441--8.01232.1527
C4-OH carnitineCAR 4:0;OHME630442--8.89248.1478
C5:1 carnitineCAR 5:1ME630444--7.86244.1531
C5 carnitineCAR 5:0ME630443--7.78246.1686
C6 carnitineCAR 6:0ME630445--7.56260.1844
C7 carnitineCAR 7:0ME630446--7.45274.2
C8 carnitineCAR 8:0ME630447--7.31288.2155
cadaverineCadaverineME630463--9.31103.1228
cAMP3',5' cyclic AMPME630625--6.99330.0578
carnitineCarnitineME630436--8.86162.1112
C-glycosyltryptophanC-GlycosyltryptophanME630464--7.1367.1477
cholineCholineME630465--8.26104.1068
citrullineCitrullineME630466--8.35176.1015
cotinine N-oxideCotinine N-oxideME630467--6.69193.0954
creatineCreatineME630468--8.33132.0763
creatinineCreatinineME630469--6.45114.0661
cyclohexylamineCyclohexylamineME630470--6.38100.1118
cystineCystineME630471--9.07241.0295
cytidineCytidineME630472--5.87244.0914
dimethylglycineDimethylglycineME630473--8.54104.0704
ectoineEctoineME630474--8.93143.0807
GABAgamma-Aminobutyric acidME630475--7.64104.0703
glutamateGlutamic acidME630476--7.65148.0595
glutamineGlutamineME630477--8.04147.0755
glutathione reducedGlutathioneME630478--7.9308.0895
glycineGlycineME630479--7.9376.0391
guanidinoacetateGuanidoacetic acidME630480--7.86118.061
guanosineGuanosineME630481--5.29284.0976
hippurateHippuric acidME630482--2.66180.0643
histamineHistamineME630483--9.18112.0868
histidineHistidineME630484--9.25156.0757
homoarginineHomoarginineME630485--9.21189.1328
homocitrullineHomocitrullineME630486--8.34190.1169
hydroxyprolineHydroxyprolineME630487--7.89132.0651
hypotaurineHypotaurineME630488--8110.0269
imidazoleacetateImidazoleacetic acidME630490--8.09127.05
imidazole propionateImidazole propanoateME630489--7.45141.0651
inosineInosineME630491--4.91269.0868
isoleucineIsoleucineME630492--7.09132.1014
kynurenateKynurenic acidME630493--5.26190.0482
L-alpha-glutamyl-L-LysineGlu-LysME630494--9.7276.154
leucineLeucineME630495--6.96132.1014
leu-glyLeu-GlyME630496--7.48189.1217
linoleoyl ethanolamideLinoleoyl-EAME630497--1.99324.2879
lysineLysineME630498--9.38147.1119
methionineMethionineME630499--7.04150.0574
methionine sulfoxideMethionine sulfoxideME630500--8.65166.052
methylguanidineMethylguanidineME630502--6.7674.071
methylimidazoleacetateMethylimidazoleacetic acidME630503--8.91141.0652
methyl N-methylanthranilateMethyl N-methylanthranilateME630501--1.98166.085
methylthioadenosineMethylthioadenosineME630504--4.24298.0952
myristoleateMyristoleic acidME630505--1.67227.1986
N1-acetylspermidineN1-AcetylspermidineME630506--9.73188.1741
N1-methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME630507--4.3153.0649
N4-acetylcytidineN4-AcetylcytidineME630508--4.24286.1015
N6-acetyllysineN6-AcetyllysineME630511--8.37189.1216
N6-methyllysineN(6)-MethyllysineME630512--9.68161.1274
N6,N6-dimethyllysineN(6),N(6)-Dimethyl-lysineME630510--10.26175.1427
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME630509--11.24189.158
N-acetylalanineN-AcetylalanineME630513--4132.065
N-acetylaspartateN-Acetylaspartic acidME630514--4.64176.0538
N-acetylgalactosamineN-Acetyl-D-galactosamineME630435--5.53222.0955
N-acetylglutamineN-AcetylglutamineME630515--7.1189.0851
N-acetylhistamineN-AcetylhistamineME630516--7.71154.0966
N-acetylhistidineN-AcetylhistidineME630517--8.37198.083
N-acetylleucineN-AcetylleucineME630518--2.9174.1111
N-acetylmethionineN-AcetylmethionineME630519--3.65192.0671
N-acetylornithineN-AcetylornithineME630520--8.41175.1063
N-acetylputrescineN-AcetylputrescineME630521--7.9131.1175
N-acetylserotoninN-AcetylserotoninME630522--2.6219.111
N-alpha-acetylargininePelargonidinME630523--8.18217.1278
N-carbamoyl-beta-alanineUreidopropionic acidME630524--4.17133.0604
niacinamideNiacinamideME630525--3.83123.0552
N-lauroylglycineNAGly 12:0ME630526--2.4258.2051
N-methylprolineN-Methyl-prolineME630527--8.62130.0858
NMMATarginineME630528--9.36189.1329
ornithineOrnithineME630529--9.27133.0967
pantothenatePantothenic acidME630530--3.14220.1162
pantothenolPantothenolME630531--3.9206.1368
phenylalaninePhenylalanineME630532--6.7166.0849
phenylalanine-d8PhenylalanineME630399--6.71174.135
phosphocholineCholine phosphateME630533--10.96184.0716
phytosphingosinePhytosphingosineME630621--5.84318.2984
pipecolatePipecolic acidME630534--7.98130.0859
pro-glyPro-GlyME630535--8.5173.0908
prolineProlineME630536--8.11116.0705
proline-betaineProline betaineME630537--9.23144.1011
putrescinePutrescineME630538--9.3589.1071
ribothymidineRibothymidineME630539--2.42259.0921
S-adenosylhomocysteineS-AdenosylhomocysteineME630540--8.13385.1265
S-adenosylmethionineS-AdenosylmethionineME630541--10.15399.1423
SDMASymmetric dimethylarginineME630542--9.64203.1485
serineSerineME630543--7.68106.0497
serotoninSerotoninME630544--6.24177.1008
S-methyl-L-cysteine-S-oxideS-Methylcysteine S-oxideME630545--8.56152.0377
spermidineSpermidineME630546--11.17146.1643
sphinganineSphinganineME630622--5.74302.3035
sphingosineSphingosineME630620--5.72300.288
taurineTaurineME630547--6.13126.0217
thiamineThiamineME630548--9.67265.1106
threonineThreonineME630549--7.62120.0655
thymidineThymidineME630550--3.05243.0961
trigonellineTrigonellineME630551--8.89138.0543
trimethylamine-N-oxideTrimethylamine N-oxideME630552--8.1376.0755
trimethylbenzeneTrimethylbenzeneME630553--1.75121.1012
tryptophanTryptophanME630554--6.49205.0952
tyrosineTyrosineME630555--6.81182.0795
urateUric acidME630556--4.22169.0344
urocanateUrocanic acidME630557--4.54139.0495
valineValineME630558--7.41118.0861
valine-d8ValineME630400--7.42126.1363
warfarinWarfarinME630559--1.71309.1087
xanthineXanthineME630560--3.8153.0397
xanthosineXanthosineME630561--4.39285.0813


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