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Details of Octanoic acid, 8-amino- (3TMS)

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Role Analyte
nameOctanoic acid, 8-amino- (3TMS)
MPIMP IDA191012
isotopomerambient
formulaC17H41NO2Si3
molecular mass375.770
monoisotopic mass375.24451
InChIInChI=1S/C17H41NO2Si3/c1-21(2,3)18(22(4,5)6)16-14-12-10-11-13-15-17(19)20-23(7,8)9/h10-16H2,1-9H3
InChIKeyOPQMOFXCHOKOGJ-UHFFFAOYSA-N
substructure TMS4
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,919.08
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27680b49d3-121d-4eea-ac42-11df02d0376e%27)

Synonyms of Octanoic acid, 8-amino- (3TMS)

propertyvalue
ChemSpider ID461234
PubChem CID529230
synonymB000780
synonymOctanoic acid, 8-amino- (4TMS)
4 synonym(s)

Metabolite mapped to Octanoic acid, 8-amino- (3TMS)

Reference spectra of Octanoic acid, 8-amino- (3TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM MDN35Reference Substance
27/19/2007 11:16:30 AM VAR5Reference Substance
33/30/2011 4:52:37 PM Fiehn_GC_2010 
3 spectrum(a)
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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