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4,7,10,13,16-Docosapentaenoate (all-Z)- (8CI)

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4,7,10,13,16-Docosapentaenoate (all-Z)- <methyl-> (8CI)
SpectraBase Compound ID IvQHjUG7K73
InChI InChI=1S/C23H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h7-8,10-11,13-14,16-17,19-20H,3-6,9,12,15,18,21-22H2,1-2H3/b8-7-,11-10-,14-13-,17-16-,20-19-
InChIKey VQHJSIBYSWTMLS-NEUKSRIFSA-N
Mol Weight 344.5 g/mol
Molecular Formula C23H36O2
Exact Mass 344.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xsdO5WBBOP
Name 4,7,10,13,16-Docosapentaenoate (all-Z)- (8CI)
CAS Registry Number 31930-67-3
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O2
InChI InChI=1S/C23H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h7-8,10-11,13-14,16-17,19-20H,3-6,9,12,15,18,21-22H2,1-2H3/b8-7-,11-10-,14-13-,17-16-,20-19-
InChIKey VQHJSIBYSWTMLS-NEUKSRIFSA-N
Number of Peaks 255
RI2 2362
RI4 2439
RI5 2111
SMILES C(CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCC)(=O)OC
SPLASH splash10-00mo-9600000000-b14ff4fceb74ed4ae6dc
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 4,7,10,13,16-Docosapentaenoic acid, methyl ester, (4Z,7Z,10Z,13Z,16Z)- Me. C22:5n7
Wiley ID LM_LIPIDS2016_200