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5(Z),8(Z),11(Z),14(Z),17(Z),20(Z)-Tricosahexaenoate <methyl->
SpectraBase Compound ID 9g9K3uaZivb
InChI InChI=1S/C24H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h4-5,7-8,10-11,13-14,16-17,19-20H,3,6,9,12,15,18,21-23H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-,20-19-
InChIKey ROFVEVFCNPGNKS-JDPCYWKWSA-N
Mol Weight 356.6 g/mol
Molecular Formula C24H36O2
Exact Mass 356.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sovexDYZbE
Name 5(Z),8(Z),11(Z),14(Z),17(Z),20(Z)-Tricosahexaenoate
Classification Fatty esters; Fatty acid methyl esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 356.271530397 u
Formula C24H36O2
InChI InChI=1S/C24H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h4-5,7-8,10-11,13-14,16-17,19-20H,3,6,9,12,15,18,21-23H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-,20-19-
InChIKey ROFVEVFCNPGNKS-JDPCYWKWSA-N
Molecular Weight 356.550 g/mol
Number of Peaks 175
RI2 2510
RI4 2541
RI5 2214
SMILES C(CCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)(=O)OC
SPLASH splash10-05ox-9600000000-9c4d815e283f4e21f095
Sample Comments RI1: measured on Equity-1 (Alkanes) RI2: measured on Supelcowax-10 (FAMEs) RI3: measured on Supelcowax-10 (FAEEs) RI4: measured on SLB-5ms (Alkanes) RI5: measured on SLB-5ms (FAMEs)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Me. C23:6n3
Wiley ID LM_LIPIDS2016_173