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12,15-Octadecadienoic acid, methyl ester

View entire compound with spectra: 2 MS (GC)

12,15-Octadecadienoic acid, methyl ester
SpectraBase Compound ID 1ao1tJNfrsF
InChI InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8H,3,6,9-18H2,1-2H3/b5-4+,8-7+
InChIKey SQXLGHNKHZNVRT-AOSYACOCSA-N
Mol Weight 294.5 g/mol
Molecular Formula C19H34O2
Exact Mass 294.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID N4SkdNACOM
Name 12,15-Octadecadienoic acid, methyl ester
CAS Registry Number 57156-97-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H34O2
InChI InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8H,3,6,9-18H2,1-2H3/b5-4+,8-7+
InChIKey SQXLGHNKHZNVRT-AOSYACOCSA-N
Molecular Weight 294.479 g/mol
SMILES CC\C=C\C\C=C\CCCCCCCCCCC(=O)OC
SPLASH splash10-015d-9000000000-2873f34866bd906a16b4
Source of Spectrum Va-0-0-0
Synonyms Methyl (12E,15E)-12,15-octadecadienoate (12E,15E)-octadeca-12,15-dienoic acid methyl ester Methyl (12E,15E)-octadeca-12,15-dienoate
Wiley ID 741271