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cis, cis-9,12-Octadecadienoic acid

View entire compound with spectra: 13 NMR, 11 FTIR, 1 Raman, and 17 MS (GC)

cis, cis-9,12-Octadecadienoic acid
SpectraBase Compound ID K2IvwUhDzfD
InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
InChIKey OYHQOLUKZRVURQ-HZJYTTRNSA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lvbudyv7Tor
Name Linoleic Acid
Classification Lineolic acids and derivatives
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 280.240230268 u
Formula C18H32O2
InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
InChIKey OYHQOLUKZRVURQ-HZJYTTRNSA-N
Molecular Weight 280.452 g/mol
Number of Peaks 129
SMILES OC(CCCCCCC\C=C/C\C=C/CCCCC)=O
SPLASH splash10-015a-9200000000-4ff42c517e794ac17511
Source of Spectrum SWG-33-1491-0
Synonyms 9,12-Octadecadienoic acid (Z,Z)- Grape seed oil (9Z,12Z)-octadeca-9,12-dienoic acid
Wiley ID 1809216