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Details of Octadecadienoic acid methyl ester, 9,12-(Z,Z)-, n-

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Role Analyte
nameOctadecadienoic acid methyl ester, 9,12-(Z,Z)-, n-
MPIMP IDA210010
isotopomerambient
formulaC19H34O2
molecular mass294.473
monoisotopic mass294.25588
InChIInChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3/b8-7-,11-10-
InChIKeyWTTJVINHCBCLGX-NQLNTKRDSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O1
retention index (VAR5 method, n-alkanes C10–C36)2,089.16
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%270da0826b-2340-4e96-9022-c45a10b7a580%27)

Synonyms of Octadecadienoic acid methyl ester, 9,12-(Z,Z)-, n-

Metabolite mapped to Octadecadienoic acid methyl ester, 9,12-(Z,Z)-, n-

Reference spectra of Octadecadienoic acid methyl ester, 9,12-(Z,Z)-, n-

replicaentry datedetectionmethodspecies
411/3/2010 4:23:37 PM Schomburg_GC_2010 
12/22/2005 12:00:00 AM M[STR] 
58/28/2012 5:51:49 PM MassBank GC 2010 Ara 
32/22/2005 12:00:00 AM M[STR] 
4 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 5/21/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Strehmel N., Hummel J.
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