| SpectraBase Spectrum ID |
KeOxT86Ismm |
| Name |
9 (R), 10 (S)-methyleneoctadecanoate |
| CAS Registry Number |
10152-62-2 |
| 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 |
310.287180462 u |
| Formula |
C20H38O2 |
| InChI |
InChI=1S/C20H38O2/c1-3-4-5-6-8-11-14-18-17-19(18)15-12-9-7-10-13-16-20(21)22-2/h18-19H,3-17H2,1-2H3/t18-,19+/m0/s1 |
| InChIKey |
WKDUVICSOMXTKJ-RBUKOAKNSA-N |
| Molecular Weight |
310.522 g/mol |
| Number of Peaks |
245 |
| RI2 |
1925 |
| RI4 |
2207 |
| RI5 |
1884 |
| SMILES |
[C@]1([C@](C1)(CCCCCCCC)[H])(CCCCCCCC(=O)OC)[H] |
| SPLASH |
splash10-05ng-9200000000-042418cfc9ffa9138ece |
| 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 |
Cyclopropaneoctanoic acid, 2-octyl-, methyl ester, (1R,2S)-rel- |
| Wiley ID |
LM_LIPIDS2016_158 |
