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13,16-Octadecadienoic acid, methyl ester

View entire compound with spectra: 1 MS (GC)

13,16-Octadecadienoic acid, methyl ester
SpectraBase Compound ID KCoi1XlGxgF
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/h3-4,6-7H,5,8-18H2,1-2H3/b4-3+,7-6+
InChIKey LYRUHTQXEPJJBJ-FZWLCVONSA-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 7jRAYqPPogk
Name 13,16-Octadecadienoic acid, methyl ester
CAS Registry Number 56846-99-2
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/h3-4,6-7H,5,8-18H2,1-2H3/b4-3+,7-6+
InChIKey LYRUHTQXEPJJBJ-FZWLCVONSA-N
Molecular Weight 294.479 g/mol
SMILES COC(=O)CCCCCCCCCCC\C=C\C\C=C\C
SPLASH splash10-067l-9100000000-3594eb49f2f4bc2499b3
Source of Spectrum EP-4861-0-0
Synonyms Methyl (13E,16E)-13,16-octadecadienoate (13E,16E)-octadeca-13,16-dienoic acid methyl ester Methyl (13E,16E)-octadeca-13,16-dienoate
Wiley ID 1297678