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Details of Caffeic acid, cis- (3TMS)

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Role Analyte
nameCaffeic acid, cis- (3TMS)
MPIMP IDA199001
isotopomerambient
formulaC18H32O4Si3
molecular mass396.701
monoisotopic mass396.16084
InChIInChI=1S/C18H32O4Si3/c1-23(2,3)20-16-12-10-15(14-17(16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10-14H,1-9H3/b13-11-
InChIKeyMBIYCWDFSLHMSI-QBFSEMIESA-N
substructure TMS3
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,977.47
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27e41b163a-5274-4b66-a8f6-7332a0b048a3%27)

Synonyms of Caffeic acid, cis- (3TMS)

Metabolite mapped to Caffeic acid, cis- (3TMS)

Reference spectra of Caffeic acid, cis- (3TMS)

replicaentry datedetectionmethodspecies
19/11/2005 12:00:00 AM M[FAME4090]Standard
29/1/2001 12:00:00 AM M[2]Standard Addition
49/11/2005 12:00:00 AM M[FAME4090]Standard
51/19/2005 12:00:00 AM M[ROE] 
113/17/2010 9:36:06 AM VAR5Solanum tuberosum
128/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
611/26/2004 12:00:00 AM M[FAME4090]Standard
73/15/2005 12:00:00 AM M[6]Reference Substance
85/1/2001 12:00:00 AM M[EIGTMS]Standard
95/1/2001 12:00:00 AM M[EIGTMS]Solanum tuberosum
10 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 8/9/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Kopka J., Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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