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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,5-anhydroglucitol1,5-AnhydrosorbitolME137660--633969217
1-kestose1-KestoseME137659--1123027361
1-monopalmitinMG 16:0/0:0/0:0ME137658--901749129
1-monostearinMG 18:0/0:0/0:0ME137657--959214129
21683 glycerol-1-phosphate byproduct-ME137655--524126211
2,3-dihydroxybutanoic acid2,3-Dihydroxybutanoic acidME137656--384796292
2,5-dihydroxypyrazine2,5-DihydroxypyrazineME137661--397526241
2-deoxytetronic acid3,4-Dihydroxybutyric acidME137654--433456189
2-hydroxybutanoic acid2-Hydroxybutyric acidME137653--258161131
2-hydroxyglutaric acid2-Hydroxyglutaric acidME137652--506306247
2-hydroxyvaleric acid2-Hydroxyvaleric acidME137651--309587131
2-monooleinMG 0:0/18:1(9Z)/0:0ME137650--941794129
2-monopalmitinMG 0:0/16:0/0:0ME137649--890356129
3,6-anhydro-D-galactose3,6-Anhydro-galactoseME137648--588886231
3-hydroxybutyric acid3-Hydroxybutyric acidME137647--278829191
3-phosphoglycerate3-Phosphoglyceric acidME137646--610734227
41682 acc mass = ketodeoxyhexonate-ME137645--605091144
4-aminobutyric acid4-Aminopentanoic acidME137644--488730304
4-hydroxybutyric acid4-Hydroxybutyric acidME137643--325027233
4-hydroxyhippuric acid4-Hydroxyhippuric acidME137642--784581294
5'-deoxy-5'-methylthioadenosine5'-MethylthioadenosineME137641--967036236
5-hydroxy-3-indoleacetic acid5-Hydroxyindoleacetic acidME137640--777606290
5-methoxytryptamine5-MethoxytryptamineME137639--864466174
97455 maybe EPA-ME137638--84076493
aconitic acidcis-Aconitic acidME137637--586815229
adenineAdenineME137636--646534264
adenosineAdenosineME137635--918039236
adenosine-5-monophosphateAMPME137634--1038688169
adipic acidAdipic acidME137633--474435111
alanineAlanineME137632--244189116
alanine-alanineAla-AlaME137631--523110116
allantoic acid dehydrated-ME137630--723539259
aminomalonateAminomalonic acidME137629--455754218
arachidic acidArachidic acidME137628--856421117
arachidonic acidArachidonic acidME137627--83711591
ascorbic acidVitamin CME137626--672898332
asparagineAsparagineME137625--553078188
aspartateAspartic acidME137624--433075160
aspartic acidAspartic acidME137623--480387232
behenic acidBehenic acidME137622--920648117
benzoic acidBenzoic acidME137621--339067179
beta-alaninebeta-AlanineME137620--435564248
beta-glutamic acidIsoglutamic acidME137619--525547232
beta-glycerolphosphatesn-Glycero-2-phosphateME137618--574470243
bisphosphoglycerol-ME137617--764660299
capric acidCapric acidME137616--452386229
cellobioseCellobioseME137615--932179204
cholestan-3-olEpi-cholestanolME137614--1082070215
cholesterolCholesterolME137613--1078536129
cis-gondoic acidcis-Gondoic acidME137612--847372367
citramalic acidCitramalic acidME137611--456203247
citric acidCitric acidME137610--617342273
citrullineCitrullineME137609--623406157
conduritol-beta-expoxideConduritol epoxideME137608--701723318
creatinineCreatinineME137607--502599115
cysteineCysteineME137606--500158220
cysteine-glycineCys-GlyME137605--715335220
cystineCystineME137604--804619218
cytidine-5-monophosphateCMPME137603--974825169
dehydroascorbic acidL-Dehydroascorbic acidME137602--641371303
digalacturonic acidDigalacturonic acidME137601--988150169
doconexentDHAME137600--90281991
dodecanoic acid, isopropanol ester-ME137599--536494200
dodecanolDodecanolME137598--507619243
enolpyruvatePhosphoenolpyruvic acidME137597--234394217
erythritolErythritolME137596--471922217
erythronic acid lactoneErythrono-1,4-lactoneME137595--407495247
ethanolamineEthanolamineME137593--340131174
ethanol phosphateEthylphosphateME137594--317291211
fructoseFructoseME137592--641863307
fructose-1-phosphateFructose 1-phosphateME137591--803180387
fructose-6-phosphateFructose 6-phosphateME137590--804279315
fucoseFucoseME137589--578299160
fumaric acidFumaric acidME137588--392338245
galactinolGalactinolME137587--1017580204
galactonic acidGalactonic acidME137586--690882292
galactose-6-phosphateGalactose 6-phosphateME137585--828102387
gamma-aminobutyric acidgamma-Aminobutyric acidME137584--364801102
glucoheptuloseGlucoheptuloseME137583--828606217
gluconic acidGluconic acidME137582--693148333
glucoseGlucoseME137581--659798319
glucose-1-phosphateGlucose 1-phosphateME137580--594647217
glucose-6-phosphateGlucose 6-phosphateME137579--818275387
glutamateGlutamic acidME137578--489240174
glutamic acidGlutamic acidME137577--529100246
glutamineGlutamineME137576--600315156
glutamine dehydratedGlutamineME137575--519033227
glutaric acidGlutaric acidME137574--421596261
glutathioneGlutathioneME137573--761296213
glyceric acidGlyceric acidME137572--377495189
glycerolGlycerolME137571--344466205
glycerol-3-galactosideGalactosylglycerolME137570--800205204
glycerol-alpha-phosphatesn-Glycero-3-phosphateME137569--590747357
glycineGlycineME137568--368707248
glycocyamineGuanidoacetic acidME137567--511016171
glycolic acidGlycolic acidME137566--227215177
guanosineGuanosineME137565--954962324
heptadecanoic acidMargaric acidME137564--751309117
hexadecylglycerolMG O-16:0ME137563--867593205
hexitolSorbitolME137562--704741217
hexonic acidGluconic acidME137561--698302217
hexose-6-phosphateHexose 6-phosphateME137560--806282387
hexuronic acidHexuronic acidME137559--667373160
histidineHistidineME137558--664395154
hydroxycarbamateHydroxycarbamic acidME137557--325948278
hydroxylamineHydroxylamineME137556--253158146
hypoxanthineHypoxanthineME137555--619128265
indole-3-acetateIndoleacetic acidME137554--684929202
indole-3-lactateIndolelactic acidME137553--764586202
inosineInosineME137552--897184230
inosine-5'-monophosphateIMPME137551--1018687169
inositol-4-monophosphateInositol 4-phosphateME137550--846510315
isocitric acidIsocitric acidME137549--616323245
isoleucineIsoleucineME137548--359251158
isomaltoseIsomaltoseME137547--993307204
isothreonic acidD-Threonic acidME137546--489385292
lactic acidLactic acidME137545--215238191
lactitolLactitolME137544--959541361
lactoseLactoseME137543--935640191
lauric acidLauric acidME137542--547906117
leucineLeucineME137541--346101158
levoglucosanGlucosanME137540--569637204
linoleic acidLinoleic acidME137539--777414150
linolenic acidOctadecatrienoic acidME137538--780376108
lysineLysineME137537--663483156
lyxitolL-ArabitolME137536--573587217
maleic acidMaleic acidME137535--363611245
maleimideMaleimideME137534--245118154
malic acidMalic acidME137533--463180233
maltoseMaltoseME137532--946601204
maltotrioseMaltotrioseME137531--1176044361
mannoseMannoseME137530--645856205
melezitoseMelezitoseME137529--1146704361
melibioseMelibioseME137528--988497361
methanolphosphateMethanolphosphateME137527--289520241
methionineMethionineME137526--483560176
methionine sulfoxideMethionine sulfoxideME137525--605401128
methyltetrahydrophenanthrenone-ME137524--594337197
myristic acidMyristic acidME137523--634414117
n-acetyl-d-hexosamineN-AcetylhexosamineME137522--746341319
N-acetylglutamateN-Acetylglutamic acidME137521--604748216
N-acetylmannosamineN-Acetyl-mannosamineME137520--722897319
nicotinamideNiacinamideME137519--471602179
nicotinic acidNicotinic acidME137518--353934180
N-methylalanineN-MethylalanineME137517--286855130
nonadecanoic acidNonadecylic acidME137516--822782117
octadecanolStearyl alcoholME137515--755409327
octanoln-OctanolME137514--247010187
oleic acidOleic acidME137513--779120339
ornithineOrnithineME137512--529384142
orotic acidOrotic acidME137511--586317254
oxalic acidOxalic acidME137510--260513190
oxoprolineOxoprolineME137509--485935156
palmitic acidPalmitic acidME137508--713809313
palmitoleic acidPalmitoleic acidME137507--704511311
pantothenic acidPantothenic acidME137506--690887291
parabanic acidParabanic acidME137505--464991100
pelargonic acidPelargonic acidME137504--399229117
pentono-1,4-lactoneRibonolactoneME137503--587644102
phenaceturic acidPhenylacetylglycineME137502--65435191
phenylalaninePhenylalanineME137501--537804218
phenylethylaminePhenylethylamineME137500--510327174
phosphatePhosphoric acidME137499--345365314
phosphoenolpyruvatePhosphoenolpyruvic acidME137498--518184211
phosphoethanolaminePhosphoethanolamineME137497--603912299
phosphogluconic acidPhosphogluconic acidME137496--847013299
phthalic acidPhthalic acidME137495--567345147
pipecolinic acidPipecolic acidME137494--404121156
prolineProlineME137493--364716142
propane-1,3-diol NISTPropane-1,3-diolME137492--214380177
pseudo uridinePseudouridineME137491--813899217
p-tolyl glucuronideP-Cresol glucuronideME137490--847531180
putrescinePutrescineME137489--588872174
pyrophosphatePyrophosphateME137488--327517110
pyruvic acidPyruvic acidME137487--213805174
raffinoseRaffinoseME137486--1120886361
ribitolRibitolME137485--575497217
ribonic acidRibonic acidME137484--597646292
riboseRiboseME137483--553135217
ribose-5-phosphateRibose 5-phosphateME137482--731096315
ribulose-5-phosphateRibulose 5-phosphateME137481--735908357
sebacic acid, di(2-octyl) ester-ME137480--968699185
serineSerineME137479--395020218
shikimic acidShikimic acidME137478--611100204
sorbitolSorbitolME137477--667922217
spermidineSpermidineME137476--774747174
squaleneSqualeneME137475--97623795
stearic acidStearic acidME137474--787622117
succinate semialdehydeSuccinic acid semialdehydeME137473--297024113
succinic acidSuccinic acidME137472--370737247
sucroseSucroseME137471--912704271
sulfuric acidTG 16:0_18:1_18:1ME137470--285430227
tartaric acidTartaric acidME137469--532135292
taurineTaurineME137468--556690326
threitolThreitolME137467--467595217
threonic acidThreonic acidME137466--497572292
threonineThreonineME137465--409568218
thymidineThymidineME137464--349402170
tocopherol alphaalpha-TocopherolME137463--1067809237
tocopherol gammagamma-TocopherolME137462--1026121223
trans-4-hydroxyprolinetrans-4-HydroxyprolineME137461--460662158
tryptophanTryptophanME137460--780482202
tyrosineTyrosineME137459--671252218
UDP GlcNAcUDP-N-acetylglucosamineME137458--627437226
UDP-glucuronic acidUDP-glucuronic acidME137457--585473217
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME137456--625003226
uracilUracilME137455--385735241
ureaUreaME137454--336356189
uric acidUric acidME137453--731038441
uridineUridineME137452--861508217
valineValineME137451--313502144
xanthineXanthineME137450--701688353
xanthosineXanthosineME137449--926133325
xylitolXylitolME137448--567437217
xylonic acid isomer-ME137447--590775189
xylonolactoneD-Xylono-1,5-lactoneME137446--535176217
xyloseXyloseME137445--546699307
xyluloseXyluloseME137444--553450173


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