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Linolenic acid

View entire compound with spectra: 7 NMR, 8 FTIR, and 9 MS (GC)

Linolenic acid
SpectraBase Compound ID Hfe7Csa47nn
InChI InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-
InChIKey DTOSIQBPPRVQHS-PDBXOOCHSA-N
Mol Weight 278.44 g/mol
Molecular Formula C18H30O2
Exact Mass 278.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4y5OCPCEGAW
Name Linolenic acid
Alternate Name(s) (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O2
InChI InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-
InChIKey DTOSIQBPPRVQHS-PDBXOOCHSA-N
Literature Reference DOI 10.1002/jccs.200000152
Molecular Weight 278.436 g/mol
SMILES OC(CCCCCCC\C=C/C\C=C/C\C=C/CC)=O
SPLASH splash10-004i-9030000000-91d2235c775d98af5f47
Source of Spectrum QA-47-1134-6
Wiley ID 1795159