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Eicosa-(13,16)-dienoate <methyl->
SpectraBase Compound ID 4MBrqU3BTYK
InChI InChI=1S/C21H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h5-6,8-9H,3-4,7,10-20H2,1-2H3/b6-5+,9-8+
InChIKey DZPNZKRIXJKEQR-HHWLVVFRSA-N
Mol Weight 322.5 g/mol
Molecular Formula C21H38O2
Exact Mass 322.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wI3cigm5Aw
Name Eicosa-(13,16)-dienoate
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38O2
InChI InChI=1S/C21H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h5-6,8-9H,3-4,7,10-20H2,1-2H3/b6-5+,9-8+
InChIKey DZPNZKRIXJKEQR-HHWLVVFRSA-N
Number of Peaks 122
RI2 2049
RI4 2280
SMILES C(CCCCCCCCCCC\C=C\C\C=C\CCC)(=O)OC
SPLASH splash10-067j-9100000000-0396d63733d1c3224981
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 13,16-Eicosadienoic acid, methyl ester Me. C20:2n4
Wiley ID LM_LIPIDS2016_133