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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
2,4-Dihydroxybutanoic acid2,4-Dihydroxybutanoic acidME545613192742-1416.5219
2-Aminobutyric acid2-Aminobutyric acidME5456146657-1173.1130
3-Aminoisobutanoic acid3-Aminoisobutanoic acidME54561564956-sum-
3-indoleacetonitrile3-IndoleacetonitrileME545616351795-1875.1228
AdenineAdenineME545617190-1867.7264
AgmatineAgmatineME545618199-1743.7174
AlanineAlanineME5456195950-1079.5116
AllantoinAllantoinME545620439714-1963.3331
alpha-Tocopherolalpha-TocopherolME54562114985-3146.6502.4
Aminoadipic acidAminoadipic acidME545622469-1719.2260
ArabinoseArabinoseME54562366308-1662.9307
ArabitolArabitolME54562494154-1726.8319
ArginineArginineME5456256322-sum-
AsparagineAsparagineME5456266267-sum-
Aspartic acidAspartic acidME5456275960-1515.6232
beta-Alaninebeta-AlanineME545628239-sum-
CampesterolCampesterolME545629173183-3262.1382
CatechinCatechinME5456309064-2871.3368
Citric acidCitric acidME545631311-1819.8273
CysteineCysteineME5456325862-1556.7220
D-Malic acidD-Malic acidME54563392824-1483.7133
ErythritolErythritolME545634222285-1500205
Erythronic acidErythronic acidME5456352781043-1538.6292
EthanolamineEthanolamineME545636700-1269.8174
FructoseFructoseME5456375984-1870.2307
Fumaric acidFumaric acidME545638444972-1358.8143
GalactinolGalactinolME54563911727586-2992433
Galactonic acidGalactonic acidME545640128869-1996.4292
GalactoseGalactoseME5456416036-1880.7319
GalactosylglycerolGalactosylglycerolME545642656504-3112.8204
gamma-Aminobutyric acidgamma-Aminobutyric acidME545643119-sum-
gamma-Tocopherolgamma-TocopherolME54564492729-3005.8488
Gluconic acidGluconic acidME54564510690-2001333
GlucoseGlucoseME5456465793-1888.1160
Glucose 6-phosphateGlucose 6-phosphateME5456475958-2315.5299
Glutamic acidGlutamic acidME54564833032-1622.2246
GlutamineGlutamineME5456495961-sum-
Glyceric acidGlyceric acidME545650439194-1337.5292
GlycineGlycineME545651750-sum-
Glycolic acidGlycolic acidME545652757-1084.9147
HistidineHistidineME5456536274-sum-
HomoserineHomoserineME54565412647-1451.4218
Inositol-PhosphateInositol phosphateME545655440194-2427.7299
IsoleucineIsoleucineME5456566306-1300.3158
Isothiocyanoethylphosphate-ME545657--1243.9211
L-Dehydroascorbic acidL-Dehydroascorbic acidME545658440667-sum-
LeucineLeucineME5456596106-1278.9158
Linoleic acidLinoleic acidME5456605280450-2208.9337
LysineLysineME5456615962-sum-
Malonic acidMalonic acidME545662867-1201.8233
MaltoseMaltoseME545663439186-2731.2160
MannitolMannitolME5456646251-1930.6307
MannoseMannoseME54566518950-1878.1319
MethanolphosphateMethanolphosphateME54566613130-1176.5241
MethionineMethionineME5456676137-1515.7176
MG 16:0MG 16:0ME54566814900-2593.3371
MG 18:0MG 18:0ME54566924699-2774399
MG 18:2MG 18:2ME5456705283469-2751.1395
Myo-inositolMyo-inositolME545671892-2086.7318
Nicotinic acidNicotinic acidME545672938-1302.4180
Octadecatrienoic acidOctadecatrienoic acidME5456735280934-2214.4335
Oxoglutaric acid2-Oxoglutaric acidME54567451-1573.6198
Pentonic acid-ME54567510264-1759.1292
Pentonic acid-4-ME54567610264-1782.9292
PhenylalaninePhenylalanineME5456776140-sum-
Phosphoric acidPhosphoric acidME5456781004-1274.7299
Pipecolic acidPipecolic acidME545679439227-1371.2156
Porphyrin-ringPorphyrin-ringME5456805481287-1339184
ProlineProlineME545681145742-1303.1142
PutrescinePutrescineME5456821045-sum-
Quinic acidQuinic acidME5456836508-1857.9345
RaffinoseRaffinoseME545684439242-3356.6217
Ribonic acidRibonic acidME5456855460677-1759.4333
RiboseRiboseME5456865779-1679.1307
Scyllo-inositolMyo-inositolME545687892-2029318
SerineSerineME5456885951-1365.3218
SitosterolSitosterolME545689222284-3344.6396
sn-Glycero-2-phosphatesn-Glycero-2-phosphateME5456902526-1727.9299
sn-Glycero-3-phosphatesn-Glycero-3-phosphateME545691439162-1762.7299
SorbitolSorbitolME5456925780-1938.2307
StachyoseStachyoseME545693439531-4405361
StigmasterolStigmasterolME5456945280794-3302484
Succinic acidSuccinic acidME5456951110-1320.9247
SucroseSucroseME5456965988-2641.2451
Sucrose 6-phosphateSucrose 6-phosphateME545697644101-3012.2315
ThreitolThreitolME545698169019-1493205
Threonic acidThreonic acidME5456995460407-1560292
ThreonineThreonineME5457006288-1389.9218
trans-Aconitic acidtrans-Aconitic acidME545701444212-1748.1375
TrehaloseTrehaloseME5457027427-2748.2191
TryptophanTryptophanME5457036305-sum-
TyramineTyramineME5457045610-1909.5174
TyrosineTyrosineME5457056057-sum-
UridineUridineME5457826029-2454224
ValineValineME5457836287-1213.6218
XylitolXylitolME5457846912-1713.2319
XyloseXyloseME545785135191-1656.7307


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