| SpectraBase Spectrum ID |
JGopIUrHUAK |
| Name |
8,11,14-Eicosatrienoic acid,methyl ester,(Z,Z,Z)- |
| CAS Registry Number |
21061-10-9 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. 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/h7-8,10-11,13-14H,3-6,9,12,15-20H2,1-2H3/b8-7-,11-10-,14-13- |
| InChIKey |
QHATYOWJCAQINT-JPFHKJGASA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
320.517 g/mol |
| Nominal Mass |
320 u |
| Quality |
977 |
| Retention Index |
2255 |
| SMILES |
C(CCCCCC\C=C/C\C=C/C\C=C/CCCCC)(OC)=O |
| SPLASH |
splash10-000x-9200000000-eea25f43d23e3f783d3c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl (8Z,11Z,14Z)-icosa-8,11,14-trienoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032984 |
