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Details of Octadecenoic acid, 9-(Z)- (1TMS)

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Role Analyte
nameOctadecenoic acid, 9-(Z)- (1TMS)
MPIMP IDA222001
isotopomerambient
formulaC21H42O2Si
molecular mass354.643
monoisotopic mass354.29541
InChIInChI=1S/C21H42O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h12-13H,5-11,14-20H2,1-4H3/b13-12-
InChIKeyGAODWSYPSJBKGB-SEYXRHQNSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,221.65
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27361310d8-2636-47e8-b915-5ca44dc46c54%27)

Synonyms of Octadecenoic acid, 9-(Z)- (1TMS)

propertyvalue
ChemSpider ID4518286
PubChem CID5366433
2 synonym(s)

Metabolite mapped to Octadecenoic acid, 9-(Z)- (1TMS)

metabolitestereoisomerisotopomer
Oleic acidn- ambient
1 metabolite(s)

Reference spectra of Octadecenoic acid, 9-(Z)- (1TMS)

replicaentry datedetectionmethodspecies
1611/3/2010 4:22:38 PM Schomburg_GC_2010 
11/22/2005 12:00:00 AM M[ROE] 
27/19/2007 11:16:30 AM MDN35Reference Substance
35/1/2001 12:00:00 AM M[EIGTMS]Standard
42/1/2005 12:00:00 AM M[6]Reference Substance
511/1/2001 12:00:00 AM M[EIGTMS]Corynebacterium glutamicum
65/1/2003 12:00:00 AM M[2]Spathodea campanulata P. Beauv.
173/30/2011 4:52:37 PM Fiehn_GC_2010 
77/19/2007 11:16:30 AM VAR5Reference Substance
85/12/2005 12:00:00 AM M[NIST] 
18 spectrum(a)
    of 2    
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
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