SpectraBase Spectrum ID |
29Cfb5IDtbJ |
Name |
5(Z),11(Z),14(Z)-eicosatrienoate |
CAS Registry Number |
82729-72-4 |
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 |
320.271530397 u |
Formula |
C21H36O2 |
InChI |
InChI=1S/C21H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h15-20H,3-14H2,1-2H3/b16-15-,18-17-,20-19- |
InChIKey |
OTGPOJAJEGAHRA-BZFGXCDFSA-N |
Molecular Weight |
320.517 g/mol |
Number of Peaks |
243 |
RI2 |
2092 |
RI4 |
2271 |
RI5 |
1942 |
SMILES |
C(\C=C/C=C\C=C/CCCCCCCCCCCCC)(=O)OC |
SPLASH |
splash10-00lr-9500000000-369ea844c80202fb5c02 |
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 |
Eicosatrienoic acid, methyl ester, (Z,Z,Z)- (9CI)
Me. C20:3n6 |
Wiley ID |
LM_LIPIDS2016_221 |