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Details of Octadecatrienoic acid, 6,9,12-(Z,Z,Z)-, n- (1TMS)

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Role Analyte
nameOctadecatrienoic acid, 6,9,12-(Z,Z,Z)-, n- (1TMS)
MPIMP IDA219008
isotopomerambient
formulaC21H38O2Si
molecular mass350.611
monoisotopic mass350.26411
InChIInChI=1S/C21H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h9-10,12-13,15-16H,5-8,11,14,17-20H2,1-4H3/b10-9-,13-12-,16-15-
InChIKeyYTIJXHGXJIJZKZ-YOILPLPUSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,190.96
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2795449928-0a4b-45fa-9018-3de6013533b9%27)

Synonyms of Octadecatrienoic acid, 6,9,12-(Z,Z,Z)-, n- (1TMS)

propertyvalue
no synonym(s) available!

Metabolite mapped to Octadecatrienoic acid, 6,9,12-(Z,Z,Z)-, n- (1TMS)

Reference spectra of Octadecatrienoic acid, 6,9,12-(Z,Z,Z)-, n- (1TMS)

replicaentry datedetectionmethodspecies
28/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
11/25/2005 12:00:00 AM M[MOR] 
2 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 Hummel J.
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