SpectraBase Spectrum ID |
8xYfJDHh8S0 |
Name |
5(Z),11(Z),14(Z),17(Z)-eicosatetraenoate |
CAS Registry Number |
59149-01-8 |
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 |
318.255880333 u |
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 |
Molecular Weight |
318.501 g/mol |
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 |
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 |
5,11,14,17-Eicosatetraenoic acid, methyl ester, (5Z,11Z,14Z,17Z)-
Me. C20:4n3 |
Wiley ID |
LM_LIPIDS2016_222 |