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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-MethyladenosineME630163--7.63282.1191
1-methylguanosine1-MethylguanosineME630164--4.99298.1137
1-methylhistamine1-MethylhistamineME630165--9.55126.1028
1-methylnicotinamide1-Methyl nicotinamideME630166--8.19137.0707
21-deoxycortisol21-DeoxycortisolME630167--2.02347.2209
2'-deoxyadenosineDeoxyadenosineME630168--5.17252.1084
2'-deoxycytidineDeoxycytidineME630169--5.95228.0967
2'-O-methyladenosine2'-O-MethyladenosineME630170--4.64282.1191
3-methoxytyramine3-MethoxytyramineME630171--6.33168.1011
3-methylhistidine3-MethylhistidineME630172--9.76170.0916
4-guanidinobutanoate4-Guanidinobutanoic acidME630173--7.27146.092
4-pyridoxate4-Pyridoxic acidME630174--3.97184.0594
5-hydroxytryptophol5-HydroxytryptopholME630175--1.84178.0852
5-methylcytidine5-MethylcytidineME630176--6258.108
5-methylcytosine5-MethylcytosineME630177--6.09126.0662
7-methylguanine7-MethylguanineME630178--5.74166.0716
acetylcholineAcetylcholineME630179--7.74146.1171
acisogaAcisogaME630180--5.61185.1274
adenosineAdenosineME630181--4.99268.1036
ADMADimethylarginineME630182--9.7203.1492
agmatineAgmatineME630183--9.07131.1292
ala-alaAla-AlaME630184--7.87161.0915
alanineAlanineME630185--7.7690.0551
allantoinAllantoinME630186--3.6159.0507
alpha-glycerophosphocholinesn-Glycero-3-phosphocholineME630187--10.38258.1097
anserineAnserineME630188--10.42241.1285
arachidoyl ethanolamideEicosanoyl-EAME630189--1.98356.3513
arginineArginineME630190--9.07175.1181
asparagineAsparagineME630191--7.86133.0607
aspartateAspartic acidME630192--7.9134.0447
beta-alaninebeta-AlanineME630193--7.9890.0551
beta-guanidinopropionate3-Guanidinopropanoic acidME630194--7.46132.0767
betaineBetaineME630195--8.95118.0865
biliverdinBiliverdinME630196--1.95583.2537
biopterinBiopterinME630197--5.15238.0925
biotinBiotinME630198--3.83245.0948
butyrobetaine3-DehydroxycarnitineME630199--8.78146.1171
C10 carnitineCAR 10:0ME630213--7.08316.2473
C12:1 carnitineCAR 12:1ME630215--6.94342.2629
C12 carnitineCAR 12:0ME630214--6.89344.2785
C14:0 LPCLPC 14:0ME630335--7.83468.3077
C14:0 SMSM 18:1;O2/14:0ME630386--7.2675.5387
C14:1 carnitineCAR 14:1ME630217--6.74370.2942
C14:2 carnitineCAR 14:2ME630218--6.79368.2786
C14 carnitineCAR 14:0ME630216--6.74372.3098
C16:0 Ceramide (d18:1)Cer 18:1;O2/16:0ME630396--1.86538.5196
C16:0 LPCLPC 16:0ME630337--7.68496.3391
C16:0 LPELPE 16:0ME630352--6.23454.2921
C16:0 SMSM 18:1;O2/16:0ME630388--7.13703.5702
C16:1 LPCLPC 16:1ME630336--7.75494.3236
C16:1 LPC plasmalogenLPC P-16:1 or LPC O-16:2ME630349--7.51480.3441
C16:1 SMSM 18:1;O2/16:1ME630387--7.14701.555
C16 carnitineCAR 16:0ME630219--6.61400.341
C16-OH carnitineCAR 16:0;OHME630220--7.06416.3361
C18:0 LPCLPC 18:0ME630342--7.57524.3709
C18:0 LPE ALPE 18:0ME630356--6.17482.3235
C18:0 LPE BLPE 18:0ME630357--7.75482.3235
C18:0 SMSM 18:1;O2/18:0ME630390--7.05731.6022
C18:1 carnitineCAR 18:1ME630222--6.53426.3568
C18:1 LPC ALPC 18:1ME630340--7.62522.3553
C18:1 LPC BLPC 18:1ME630341--7.49522.3553
C18:1 LPC plasmalogen ALPC P-18:0 or LPC O-18:1ME630350--7.72508.3757
C18:1 LPC plasmalogen BLPC P-18:0 or LPC O-18:1ME630351--7.39508.3758
C18:1 LPELPE 18:1ME630355--6.19480.3079
C18:1-OH carnitineCAR 18:1;OHME630223--6.97442.3518
C18:1 SMSM 18:1;O2/18:1ME630389--7.06729.5868
C18:2 carnitineCAR 18:2ME630224--6.59424.3411
C18:2 LPCLPC 18:2ME630339--7.67520.3395
C18:2 LPELPE 18:2ME630354--6.22478.2923
C18:3 LPCLPC 18:3ME630338--7.69518.3213
C18:3 LPELPE 18:3ME630353--6.23476.2741
C18 carnitineCAR 18:0ME630221--6.51428.3724
C20:0 LPELPE 20:0ME630359--7.62510.355
C20:0 SMSM 18:1;O2/20:0ME630391--6.98759.6311
C20:1 LPCLPC 20:1ME630345--7.49550.387
C20:3 LPCLPC 20:3ME630344--7.45546.3531
C20:4 carnitineCAR 20:4ME630226--6.48448.3411
C20:4 LPCLPC 20:4ME630343--7.6544.3398
C20:4 LPELPE 20:4ME630358--6.09502.2924
C20 carnitineCAR 20:0ME630225--6.41456.4041
C22:0 SMSM 18:1;O2/22:0ME630392--6.93787.6613
C22:4 LPCLPC 22:4ME630347--7.39572.3694
C22:6 LPCLPC 22:6ME630346--7.43568.3378
C22:6 LPELPE 22:6ME630360--6.06526.2929
C24:0 LPCLPC 24:0ME630348--7.26608.464
C24:1 ceramide (d18:1)Cer 18:1;O2/24:1ME630397--1.8648.6261
C26 carnitineCAR 26:0ME630227--6.19540.4986
C2 carnitineCAR 2:0ME630202--8.68204.1219
C30:0 PCPC 30:0ME630361--6.63706.534
C32:2 PCPC 32:2ME630362--6.59730.5346
C34:0 PEPE 34:0ME630372--6.61720.5498
C34:1 DAGDG 34:1ME630398--1.6617.5107
C34:2 PEPE 34:2ME630371--5.46716.5187
C34:2 PE plasmalogenPE P-34:1 or PE O-34:2ME630379--5.4702.539
C34:3 PCPC 34:3ME630364--6.55756.5473
C34:3 PC plasmalogenPC P-34:2 or PC O-34:3ME630366--6.5742.5708
C34:3 PE plasmalogenPE P-34:2 or PE O-34:3ME630378--5.41700.5234
C34:4 PCPC 34:4ME630363--6.51754.5318
C36:2 PCPC 36:2ME630365--6.5786.5946
C36:2 PEPE 36:2ME630374--5.43744.5502
C36:2 PS plasmalogenPS O-36:2ME630385--6.62774.5596
C36:3 PE plasmalogenPE P-36:2 or PE O-36:3ME630368--5.38728.5548
C36:4 PEPE 36:4ME630373--5.39740.5191
C36:5 PC plasmalogenPC P-36:4 or PC O-36:5ME630367--6.41766.5688
C36:5 PE plasmalogenPE P-36:4 or PE O-36:5ME630380--5.34724.5237
C38:4 PEPE 38:4ME630376--5.36768.5478
C38:5 PE plasmalogenPE P-38:4 or PE O-38:5ME630383--5.31752.5524
C38:6 PC plasmalogenPC P-38:5 or PC O-38:6ME630370--6.38792.585
C38:6 PEPE 38:6ME630375--5.37764.5167
C38:6 PE plasmalogenPE P-38:5 or PE O-38:6ME630382--5.31750.5371
C38:7 PC plasmalogenPC P-38:6 or PC O-38:7ME630369--6.38790.5693
C38:7 PE plasmalogenPE P-38:6 or PE O-38:7ME630381--5.32748.5215
C3 carnitineCAR 3:0ME630203--8.33218.1377
C3-DC carnitineCAR DC3:0ME630204--9.48248.1123
C3-DC-CH3 carnitineCAR 3:0;2MeME630205--8.57262.1282
C40:6 PEPE 40:6ME630377--5.35792.5481
C40:7 PE plasmalogenPE P-40:6 or PE O-40:7ME630384--5.29776.553
C4 carnitineCAR 4:0ME630206--7.99232.1534
C4-OH carnitineCAR 4:0;OHME630207--8.85248.1486
C5:1 carnitineCAR 5:1ME630209--7.86244.1537
C5 carnitineCAR 5:0ME630208--7.76246.1693
C6 carnitineCAR 6:0ME630210--7.55260.1852
C7 carnitineCAR 7:0ME630211--7.38274.2009
C8 carnitineCAR 8:0ME630212--7.29288.2164
cadaverineCadaverineME630228--9.26103.1232
carnitineCarnitineME630201--8.81162.1118
carnosineCarnosineME630229--9.7227.1127
C-glycosyltryptophanC-GlycosyltryptophanME630230--7.06367.1489
cholineCholineME630231--8.24104.1071
citrullineCitrullineME630232--8.31176.102
cotinine N-oxideCotinine N-oxideME630233--6.69193.0961
creatineCreatineME630234--8.29132.0767
creatinineCreatinineME630235--6.44114.0665
cyclohexylamineCyclohexylamineME630236--6.38100.1122
cystineCystineME630237--8.99241.0301
cytidineCytidineME630238--5.82244.0921
diacetylspermineN1,N12-DiacetylspermineME630239--10.29287.2439
dimethylglycineDimethylglycineME630240--8.5104.0708
ectoineEctoineME630241--8.89143.0812
GABAgamma-Aminobutyric acidME630242--7.56104.0707
glutamateGlutamic acidME630243--7.6148.06
glutamineGlutamineME630244--7.98147.076
glutathione reducedGlutathioneME630245--7.85308.0904
glycineGlycineME630246--7.8876.0393
glycocholateGlycocholic acidME630247--5.34466.3155
guanidinoacetateGuanidoacetic acidME630248--7.84118.0614
guanosineGuanosineME630249--5.25284.0984
hippurateHippuric acidME630250--2.65180.0646
histamineHistamineME630251--9.13112.0872
histidineHistidineME630252--9.19156.0762
homoarginineHomoarginineME630253--9.15189.1334
homocysteineHomocysteineME630254--6.99136.0424
hydroxyprolineHydroxyprolineME630255--7.84132.0655
hypotaurineHypotaurineME630256--7.95110.0273
imidazoleacetateImidazoleacetic acidME630258--8.05127.0504
imidazole propionateImidazole propanoateME630257--7.42141.0656
inosineInosineME630259--4.86269.0876
isoleucineIsoleucineME630260--7.06132.1019
kynurenateKynurenic acidME630261--5.23190.0488
L-alpha-glutamyl-L-LysineGlu-LysME630262--9.64276.1543
leucineLeucineME630263--6.93132.1019
leu-glyLeu-GlyME630264--7.45189.1223
linoleoyl ethanolamideLinoleoyl-EAME630265--1.99324.2889
lysineLysineME630266--9.31147.1124
methionineMethionineME630267--6.99150.0578
methionine sulfoxideMethionine sulfoxideME630268--8.59166.0526
methylguanidineMethylguanidineME630269--6.7574.0713
methylimidazoleacetateMethylimidazoleacetic acidME630270--8.87141.0656
methylthioadenosineMethylthioadenosineME630271--4.23298.0962
myristoleateMyristoleic acidME630272--1.68227.1995
N1-acetylspermidineN1-AcetylspermidineME630273--9.75188.1747
N1-acetylspermineN1-AcetylspermineME630274--11245.2329
N1-methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME630275--4.3153.0653
N2,N2-dimethylguanosineN2,N2-DimethylguanosineME630276--5.32312.1294
N4-acetylcytidineN4-AcetylcytidineME630277--4.26286.1028
N6-acetyllysineN6-AcetyllysineME630280--8.35189.1222
N6-methyllysineN(6)-MethyllysineME630281--9.54161.1279
N6,N6-dimethyllysineN(6),N(6)-Dimethyl-lysineME630279--10.2175.1433
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME630278--11.16189.1587
N-acetylalanineN-AcetylalanineME630282--3.61132.0655
N-acetylaspartateN-Acetylaspartic acidME630283--4.56176.0544
N-acetylgalactosamineN-Acetyl-D-galactosamineME630200--5.48222.0962
N-acetylglutamineN-AcetylglutamineME630284--7.04189.0858
N-acetylhistamineN-AcetylhistamineME630285--7.7154.0969
N-acetylleucineN-AcetylleucineME630286--2.87174.1116
N-acetylmethionineN-AcetylmethionineME630287--2.91192.0678
N-acetylornithineN-AcetylornithineME630288--8.37175.1068
N-acetylputrescineN-AcetylputrescineME630289--7.88131.1179
N-acetylserotoninN-AcetylserotoninME630290--2.54219.1118
N-acetyltryptophanN-Acetyl-tryptophanME630291--2.81247.1071
N-alpha-acetylargininePelargonidinME630292--8.15217.1285
N-carbamoyl-beta-alanineUreidopropionic acidME630293--4.13133.0607
niacinamideNiacinamideME630294--3.74123.0556
nicotinateNicotinic acidME630295--3.84124.0394
N-lauroylglycineNAGly 12:0ME630296--2.39258.206
N-methylprolineN-Methyl-prolineME630297--8.6130.0863
NMMATarginineME630298--9.34189.1335
ornithineOrnithineME630299--9.19133.0971
pantothenatePantothenic acidME630300--3.04220.1169
pantothenolPantothenolME630301--3.81206.1376
phenylacetylglycinePhenylacetylglycineME630302--2.84194.08
phenylalaninePhenylalanineME630303--6.67166.0855
phenylalanine-d8PhenylalanineME630161--6.68174.1356
phosphocholineCholine phosphateME630304--10.8184.0722
phytosphingosinePhytosphingosineME630394--5.82318.2994
pipecolatePipecolic acidME630305--7.95130.0862
prolineProlineME630306--8.07116.0709
proline-betaineProline betaineME630307--9.21144.1015
pseudouridinePseudouridineME630308--4.15245.0762
pterinPterinME630309--4.72164.0559
putrescinePutrescineME630310--9.389.1074
pyridoxaminePyridoxamineME630311--9.02169.0963
S-adenosylhomocysteineS-AdenosylhomocysteineME630312--8.08385.1279
S-adenosylmethionineS-AdenosylmethionineME630313--10.07399.1436
SDMASymmetric dimethylarginineME630314--9.58203.1492
serineSerineME630315--7.62106.0501
serotoninSerotoninME630316--6.22177.1013
S-methyl-L-cysteine-S-oxideS-Methylcysteine S-oxideME630317--8.5152.0381
sphinganineSphinganineME630395--5.73302.3046
sphingosineSphingosineME630393--5.71300.289
taurineTaurineME630318--6.08126.0221
thiamineThiamineME630319--9.66265.1114
threonineThreonineME630320--7.56120.0659
trigonellineTrigonellineME630321--8.85138.0547
trimethylamine-N-oxideTrimethylamine N-oxideME630322--8.1276.0757
trimethylbenzeneTrimethylbenzeneME630323--2.01121.1016
tryptamineTryptamineME630324--6.06161.1066
tryptophanTryptophanME630325--6.46205.0959
tyramineTyramineME630326--6.24138.0911
tyrosineTyrosineME630327--6.77182.0801
urateUric acidME630328--4.15169.0348
urobilinL-UrobilinME630329--6.54595.3475
urocanateUrocanic acidME630330--4.55139.05
valineValineME630331--7.37118.0865
valine-d8ValineME630162--7.39126.1367
warfarinWarfarinME630332--1.72309.1116
xanthineXanthineME630333--3.74153.0402
xanthosineXanthosineME630334--4.36285.0826


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