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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
phosphatePhosphoric acidME2508681004C00009345365314
pyruvic acidPyruvic acidME2508661060C00022213805174
glycineGlycineME250891750C00037368707248
alanineAlanineME2509125950C00041240378116
succinic acidSuccinic acidME2508601110C00042370737247
sulfuric acidTG 16:0_18:1_18:1ME2508581118C00059282411227
ureaUreaME2508541176C00086326574189
sucroseSucroseME2508595988C00089916229271
beta-alaninebeta-AlanineME250910239C00099435564248
glucose-1-phosphateGlucose 1-phosphateME25089565533C00103594647217
glycerolGlycerolME250893753C00116344428205
riboseRiboseME2508645779C00121553135217
fumaric acidFumaric acidME250900444972C00122390016245
myo-inositolMyo-inositolME250878892C00137730022305
citric acidCitric acidME250906311C00158617342273
glycolic acidGlycolic acidME250890757C00160227215177
benzoic acidBenzoic acidME250911243C00180339067179
xyloseXyloseME250853135191C00181543267103
dihydroxyacetoneDihydroxyacetoneME250905670C0018433212089
ethanolamineEthanolamineME250903700C00189343800174
hydroxylamineHydroxylamineME250886787C00192255241146
gluconic acid lactoneGluconolactoneME2508977027C00198645815220
oxalic acidOxalic acidME250874971C00209260513190
palmitic acidPalmitic acidME250872985C00249713809313
nicotinic acidNicotinic acidME250876938C00253353934180
glyceric acidGlyceric acidME250894439194C00258377495189
4-aminobutyric acid4-Aminopentanoic acidME250915119C00334488730304
lyxoseLyxoseME250880439240C00476541086217
raffinoseRaffinoseME250865439242C004921120886361
shikimic acidShikimic acidME2508628742C00493611100204
malic acidMalic acidME250879525C00711463180233
oleic acidOleic acidME250875445639C00712779120339
ketohexoseKetohexoseME250884439312C00795627414307
tagatoseD-TagatoseME250857439312C00795629499307
gluconic acidGluconic acidME2508986857417C00800693148333
4-hydroxybutyric acid4-Hydroxybutyric acidME25091410413C00989325027233
3-hydroxypropionic acidHydroxypropionic acidME25091668152C01013269265177
galactinolGalactinolME25089911727586C012351017580204
inulotrioseLevanME25088522833608C013551131821361
lactic acidLactic acidME250883612C01432217657191
stearic acidStearic acidME2508615281C01530787622117
capric acidCapric acidME2509072969C01571452386229
pelargonic acidPelargonic acidME2508718158C01601399229117
threonic acidThreonic acidME2508555460407C01620497572292
erythroseErythroseME250904439574C01796443306205
oxoprolineOxoprolineME2508737405C01879485935156
fucoseFucoseME250901439650C02095578299160
fructoseFructoseME250902439709C02336639442307
propane-1,3-diol NISTPropane-1,3-diolME25086710442C02457214380177
lauric acidLauric acidME2508823893C02679547906117
1-kestose1-KestoseME250920440080C036611123027361
3-aminoisobutyric acid3-Aminoisobutanoic acidME25091764956C05145452655248
phenylethylaminePhenylethylamineME2508691001C05332510327174
glycerol-3-galactosideGalactosylglycerolME25089216048618C05401805227204
salicylaldehyde2-HydroxybenzaldehydeME2508636998C06202406586193
myristic acidMyristic acidME25087711005C06424634414285
beta-gentiobiosebeta-GentiobioseME250909441422C08240973116204
6-deoxyglucoseQuinovoseME250913441480C08352573663117
threitolThreitolME250856169019C16884467595217
pentitolArabitolME250870827D00061563801307
1-deoxyerythritol1-DeoxyerythritolME25092120497-357129117
1-methylgalactose NIST-ME2509192108-664807204
2-deoxyerythritol2-DeoxyerythritolME25091818302-354388117
butyrolactam NIST2-PyrrolidinoneME25090812025-277199142
glucoseGlucoseME250896--678811217
heptadecanoic acidMargaric acidME25088910465-751309117
hexadecaneHexadecaneME25088811006-52596485
hydroxycarbamate NISTHydroxycarbamic acidME25088716639161-325318278
levoglucosanGlucosanME2508812724705-569637204


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