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(E,E)-9-OXOOCTADECA-10,12-DIENOIC-ACID

View entire compound with spectra: 1 NMR, and 3 MS (GC)

(E,E)-9-OXOOCTADECA-10,12-DIENOIC-ACID
SpectraBase Compound ID H7lItbXlUME
InChI InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6+,14-11+
InChIKey LUZSWWYKKLTDHU-SIGMCMEVSA-N
Mol Weight 294.43 g/mol
Molecular Formula C18H30O3
Exact Mass 294.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AN9kFMaEYxL
Name 10,12-OCTADECADIENOIC ACID, 9-OXO-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H30O3
InChI InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6+,14-11+
InChIKey LUZSWWYKKLTDHU-SIGMCMEVSA-N
Molecular Weight 294.2187
SMILES OC(CCCCCCCC(=O)\C=C\C=C\CCCCC)=O
SPLASH splash10-0gc1-9520000000-676ac576dbb3b36c1d9f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany