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Methyl (2E,4Z,8Z,11Z,14Z,17Z)-icosa-2,4,8,11,14,17-hexaenoate

View entire compound with spectra: 1 MS (GC)

Methyl (2E,4Z,8Z,11Z,14Z,17Z)-icosa-2,4,8,11,14,17-hexaenoate
SpectraBase Compound ID AaIaWvBEvTk
InChI InChI=1S/C21H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,17-20H,3,6,9,12,15-16H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,18-17-,20-19+
InChIKey JZLZTVVCYFSSPJ-OPYPHUDCSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVMmdusF203
Name Methyl (2E,4Z,8Z,11Z,14Z,17Z)-icosa-2,4,8,11,14,17-hexaenoate
Alternate Name(s) (2E,4Z,8Z,11Z,14Z,17Z)-eicosa-2,4,8,11,14,17-hexaenoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,17-20H,3,6,9,12,15-16H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,18-17-,20-19+
InChIKey JZLZTVVCYFSSPJ-OPYPHUDCSA-N
Molecular Weight 314.469 g/mol
SMILES C(\C=C\C=C/CC\C=C/C\C=C/C\C=C/C\C=C/CC)(=O)OC
SPLASH splash10-004i-9000000000-0236a14e2d4aae7b2387
Source of Spectrum KC-0-3074-6
Wiley ID 831535