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methyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
SpectraBase Compound ID Gzp4tNGs2sF
InChI InChI=1S/C21H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-
InChIKey QWDCYFDDFPWISL-JEBPEJKESA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uiCCw0Ktc4
Name (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoic acid methyl ester
CAS Registry Number 2734-47-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-
InChIKey QWDCYFDDFPWISL-JEBPEJKESA-N
Molecular Weight 316.485 g/mol
SMILES C(=O)(OC)CCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC
SPLASH splash10-03n9-0930000000-6cc2b9a46f2349d06469
Source of Spectrum B3-0-19-1
Synonyms 5,8,11,14,17-Eicosapentaenoic acid, methyl ester, (all-Z)- Methyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
Wiley ID 1317285