| SpectraBase Spectrum ID |
40G8zUbP3wb |
| Name |
12,15-Octadecadienoic acid,methyl ester |
| CAS Registry Number |
57156-97-5 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
294.255880333 u |
| Formula |
C19H34O2 |
| InChI |
InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8H,3,6,9-18H2,1-2H3/b5-4-,8-7+ |
| InChIKey |
SQXLGHNKHZNVRT-KXKKYDSASA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
294.479 g/mol |
| Nominal Mass |
294 u |
| Quality |
950 |
| Retention Index |
2067 |
| SMILES |
C(CCCCCCCCCC\C=C\C\C=C/CC)(OC)=O |
| SPLASH |
splash10-015a-9200000000-d794714bae381fd8888b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl octadeca-12,15-dienoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031060 |
