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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
galactinolGalactinolME13617311727586C012351017580204
inosine-5-monophosphateIMPME1361438582C001301018687169
1-methylinosine NIST1-MethylinosineME13623065095-1026110259
cerotinic aciCerotic acidME13619710469-1033286145
adenosine-5-monophosphateAMPME1362136083C000201041375315
tocopherol alpha-alpha-TocopherolME136070638015C003761067809237
cholesterolCholesterolME1361965997C001871078536129
dihydrocholesterolDihydrocholesterolME13618566066C129781082070215
pyruvic acidPyruvic acidME1360871060C00022211668174
lactic acidLactic acidME136138612C01432217657191
glycolic acidGlycolic acidME136159757C00160227636177
alanineAlanineME1362115950C00041243971116
maleimideMaleimideME13612810935C07272245118154
hydroxylamineHydroxylamineME136147787C00192253158146
oxalic acidOxalic acidME136106971C00209260513190
N-methylalanineN-MethylalanineME136112-C02721285825130
methanolphosphateMethanolphosphateME13612413130-289520241
valineValineME1360606287C00183313502144
pyrophosphatePyrophosphateME1360881023C00013327517110
dihydroxyacetoneDihydroxyacetoneME136184670C0018433212089
ureaUreaME1360621176C00086338716189
benzoic acidBenzoic acidME136202243C00180339214179
ethanolamineEthanolamineME136179700C00189343800174
leucineLeucineME1361336106C00123345168158
phosphatePhosphoric acidME1360961004C00009348274314
isoleucineIsoleucineME1361406306C00407359251158
prolineProlineME136091145742C00148364716142
glycineGlycineME136161750C00037368707248
glyceric acidGlyceric acidME136164439194C00258377495189
uracilUracilME1360631174C00106385735241
fumaric acidFumaric acidME136174444972C00122390016245
serineSerineME1360815951C00065395020218
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME13623323368901-397526241
pelargonic acidPelargonic acidME1361008158C01601399229117
pipecolinic acidPipecolic acidME1360926931662-404121156
threonineThreonineME1360726288C00188409568218
thymineThymineME1360711135C00178420133255
glutaric acidGlutaric acidME136166743C00489421260261
hydroquinoneHydroquinoneME136148785C00530422583239
aspartic acidAspartic acidME1362045960C00049433075160
beta-alaninebeta-AlanineME136201239C00099435564248
erythroseErythroseME136180439574C01796443306205
homoserineHomoserineME13614912647C00263443878218
capric acidCapric acidME1361982969C01571452386229
aminomalonateAminomalonic acidME136208100714C00872455754218
trans-4-hydroxy-L-prolinetrans-4-HydroxyprolineME136069--459475158
malic acidMalic acidME136127525C00711463180233
nicotinamideNiacinamideME136113936C00153471602179
erythritolErythritolME136181222285C00503471922217
adipic acidAdipic acidME136212196C06104474435111
methionineMethionineME1361236137C00073483560176
oxoprolineOxoprolineME1361057405C01879485935156
glutamic acidGlutamic acidME13616833032C00025489240174
isothreonic acidD-Threonic acidME136139151152C00639489385292
2-hydroxypyrazinyl-2-propenoic acid ethyl ester NI...-ME136225--493127121
threonic acidThreonic acidME1360735460407C01620497572292
cysteineCysteineME1361925862C00097500158220
creatinineCreatinineME136193588C00791502599115
2-hydroxyglutaric acid2-Hydroxyglutaric acidME13622643C02630506306247
alpha-ketoglutarate2-Oxoglutaric acidME13620951C00026507392198
dodecanolDodecanolME1361828193C02277507619243
glycocyamineGuanidoacetic acidME136160763C00581510732171
3-phenyllactic acidPhenyllactic acidME136221--516011193
phosphoenolpyruvatePhosphoenolpyruvic acidME136095--518184211
3 hydroxy-3-methylglutaric acid3-Hydroxymethylglutaric acidME1362221662C03761519310247
ornithineOrnithineME1361086262C00077527113142
xylonolactone NISTD-Xylono-1,5-lactoneME136056439692C02266535176217
5-aminovaleric acid5-Aminopentanoic acidME136219138C00431536657174
phenylalaninePhenylalanineME1360976140C00079537804218
xyloseXyloseME136055--544100103
lauric acidLauric acidME1361343893C02679547906117
N-acetylaspartic acidN-Acetylaspartic acidME13611865065C01042548028158
asparagineAsparagineME1362056267C00152553078188
riboseRiboseME1360855779C00121553135217
xylulose NISTXyluloseME136054439205C00312553450173
taurineTaurineME1360751123C00245556690326
pentitolArabitolME136098827D00061563801307
xylitolXylitolME1360576912C00379567437217
levoglucosanGlucosanME1361322724705-569637204
arabitolArabitolME13620794154C01904570685217
alpha-aminoadipic acidalpha-Aminoadipic acidME136210--573295260
lyxitolL-ArabitolME136129439255C00532573587217
beta-glycerolphosphatesn-Glycero-2-phosphateME1362002526C02979574470243
ribitolRibitolME136086827C00474575497217
fucoseFucoseME136175439650C02095578299160
orotic acidOrotic acidME136107967C00295586317254
aconitic acidcis-Aconitic acidME136216643757C00417586815229
UDP-glucuronic acidUDP-glucuronic acidME13606517473C00167587601217
putrescinePutrescineME1360901049C00138588119174
glycerol-alpha-phosphatesn-Glycero-3-phosphateME136162754C03189590747357
glucose-1-phosphateGlucose 1-phosphateME13617065533C00103597071217
glutamineGlutamineME1361675961C00064600315156
phosphoethanolaminePhosphoethanolamineME1360941015C00346603912299
N-acetylglutamateN-Acetylglutamic acidME13611570914C00624604748216
3-phosphoglycerate3-Phosphoglyceric acidME136220724C00597610734227
terephthalic acidTerephthalic acidME1360747489C06337612262295
citric acidCitric acidME136194311C00158617342273
hypoxanthineHypoxanthineME136146790C00262619128265
O-phosphoserineDL-O-PhosphoserineME13610957689797C01005624355356
UDP GlcNAcUDP-N-acetylglucosamineME136064445675C00043627437226
myristic acidMyristic acidME13611911005C06424634414285
methionine sulfoxideMethionine sulfoxideME136122158980C02989637588128
fructoseFructoseME136178439709C02336641863307
hexoseHexoseME136153206C00738642640319
adenineAdenineME136215190C00147646534264
1,2-anhydro-myo-inositol NIST1,2-Anhydro-myo-inositolME136232119054-651472318
p-hydroxylphenyllactic acid4-Hydroxyphenyllactic acidME1360939378C03672654036308
glucoseGlucoseME13617164689C00221659798319
mannitolMannitolME1361266251C00392663215319
lysineLysineME1361305962C00047663483156
histidineHistidineME1361506274C00135663790154
hexuronic acidHexuronic acidME136151152867-667373160
sorbitolSorbitolME1360805780C00794667922217
tyrosineTyrosineME1360666057C00082671252218
pentadecanoic acidPentadecylic acidME13609913849C16537674647117
1-hexadecanolCetyl alcoholME1362312682C00823679596299
pantothenic acidPantothenic acidME1361016613C12276690887291
isohexonic acid-ME136141604-698302333
cytidine-5-monophosphateCMPME136188--700635243
xanthineXanthineME1360591188C00385701688353
palmitoleic acidPalmitoleic acidME136102445638C08362704511311
hexitolSorbitolME136154453C00392704741217
palmitic acidPalmitic acidME136103985C00249713809313
cysteine-glycineCys-GlyME136191439498C01419715335220
N-acetyl-D-galactosamineN-Acetyl-D-galactosamineME136117--723255202
myo-inositolMyo-inositolME136120892C00137730022305
ribose-5-phosphateRibose 5-phosphateME136084439167C00117731096315
N-acetylmannosamineN-Acetyl-mannosamineME136114439281C00645735323319
ribulose-5-phosphateRibulose 5-phosphateME136083439184C00199735908357
guanineGuanineME136157764C00242744307352
n-acetyl-d-hexosamineN-AcetylhexosamineME13611624139C03878746341319
heptadecanoic acidMargaric acidME13615510465-751309117
octadecanolStearyl alcoholME1361118221-755409327
glutathioneGlutathioneME136165124886C00051761296213
indole-3-lactateIndolelactic acidME13614592904C02043764586202
bisphosphoglycerol NIST-ME136199102018-764660299
oleic acidOleic acidME136110445639C00712779120339
tryptophanTryptophanME1360676305C00078780482202
stearic acidStearic acidME1360775281C01530787622117
spermidineSpermidineME1360791102C00315792924144
fructose-1-phosphateFructose 1-phosphateME136177439394C01094803180387
fructose-6-phosphateFructose 6-phosphateME136176440641C05345804279315
cystineCystineME136190595C01420804619218
glycerol-3-galactosideGalactosylglycerolME13616316048618C05401805227204
hexose-6-phosphateHexose 6-phosphateME136152208C02965806282387
glucose-6-phosphateGlucose 6-phosphateME136169439427C01172810287387
mannose-6-phosphate NISTMannose 6-phosphateME13612565127C00275822643387
pyridoxal-5-phosphatePyridoxal 5'-phosphateME1360891051C00018825754219
glucoheptuloseGlucoheptuloseME1361725459879C02076828606217
monomyristinMG 14:0ME13612179050-838305343
inositol-4-monophosphateInositol 4-phosphateME136142440043C03546845976315
cis-gondoic acidcis-Gondoic acidME1361955282768C16526847372367
dehydroabietic acidDehydroabietic acidME13618794391C12078850374239
arachidic acidArachidic acidME13620610467C06425856421117
D-erythro-sphingosineSphingosineME136186--859500204
5-methoxytryptamine5-MethoxytryptamineME1362171833C05659864466174
saccharopineSaccharopineME136082160556C00449865907156
2-monopalmitinMG 0:0/16:0/0:0ME136223123409-890356129
inosineInosineME1361446021C00294897184230
1-monopalmitinMG 16:0/0:0/0:0ME13622814900C01885901749129
docosahexaenoic acidDocosahexaenoic acidME136183--90281991
sucroseSucroseME1360765988C00089912704271
adenosineAdenosineME13621460961C00212918039236
behenic acidBehenic acidME1362038215C08281920648117
glycyl tyrosineGly-TyrME13615892829-922071174
xanthosineXanthosineME13605864959C01762926133325
spermineSpermineME136078--92970286
lactuloseLactuloseME13613511333C07064929908204
cytidineCytidineME136189--934269223
lactoseLactoseME136136440995C00243935640191
2-monooleinMG 0:0/18:1(9Z)/0:0ME1362245319879-941794129
trehaloseTrehaloseME136068--948197191
1-monooleinMG 18:1(9Z)/0:0/0:0ME1362295283468-952623129
guanosineGuanosineME1361566802C00387954962324
1-monostearinMG 18:0/0:0/0:0ME13622724699D01947959214203
lactitolLactitolME136137157355C13542959541361
5-deoxy-5-methylthioadenosine5'-MethylthioadenosineME136218439176C00170967036236
lignoceric acidLignoceric acidME13613111197C08320978597132
uridine-5-monophosphateUMPME1360616030-980179169
palatinitol1,2,3-ButanetriolME136104--996670204


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