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Benzyl (6Z,9Z,12Z)-6,9,12-octadecatrienoate
SpectraBase Compound ID HaszGpgEAa3
InChI InChI=1S/C25H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(26)27-23-24-20-17-16-18-21-24/h6-7,9-10,12-13,16-18,20-21H,2-5,8,11,14-15,19,22-23H2,1H3/b7-6-,10-9-,13-12-
InChIKey JKAJWKJEMDNKAH-QNEBEIHSSA-N
Mol Weight 368.6 g/mol
Molecular Formula C25H36O2
Exact Mass 368.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEWgINfAiZf
Name Benzyl (6Z,9Z,12Z)-6,9,12-octadecatrienoate
CAS Registry Number 77509-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36O2
InChI InChI=1S/C25H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(26)27-23-24-20-17-16-18-21-24/h6-7,9-10,12-13,16-18,20-21H,2-5,8,11,14-15,19,22-23H2,1H3/b7-6-,10-9-,13-12-
InChIKey JKAJWKJEMDNKAH-QNEBEIHSSA-N
Molecular Weight 368.561 g/mol
SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)OCc1ccccc1
SPLASH splash10-0006-9100000000-d0724991862d85e9fc2b
Source of Spectrum W5-0-0-0
Synonyms (6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid (phenylmethyl) ester (6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid benzyl ester (phenylmethyl) (6Z,9Z,12Z)-octadeca-6,9,12-trienoate 6,9,12-Octadecatrienoic acid, phenylmethyl ester, (Z,Z,Z)- benzyl (6Z,9Z,12Z)-octadeca-6,9,12-trienoate
Wiley ID 1353417