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5(Z),11(Z),14(Z),17(Z)-eicosatetraenoate <methyl->
SpectraBase Compound ID 6FkyqJyI85P
InChI InChI=1S/C21H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,16-17H,3,6,9,12-15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,17-16-
InChIKey RACNRUFXUGWSBR-IQSQJELJSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jBJfkx2xBV
Name 5(Z),11(Z),14(Z),17(Z)-eicosatetraenoate
CAS Registry Number 59149-01-8
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,16-17H,3,6,9,12-15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,17-16-
InChIKey RACNRUFXUGWSBR-IQSQJELJSA-N
Number of Peaks 233
RI2 2153
RI4 2275
RI5 1948
SMILES C(CCC\C=C/CCCC\C=C/C\C=C/C\C=C/CC)(=O)OC
SPLASH splash10-05po-9300000000-fc0c519ddf6b6300203e
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 5,11,14,17-Eicosatetraenoic acid, methyl ester, (5Z,11Z,14Z,17Z)- Me. C20:4n3
Wiley ID LM_LIPIDS2016_222