| SpectraBase Spectrum ID |
96hWNX0LFH0 |
| Name |
Fatty acid (Erucic) |
| Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula |
C22H42O2 |
| InChI |
InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9- |
| InChIKey |
DPUOLQHDNGRHBS-KTKRTIGZSA-N |
| SMILES |
OC(CCCCCCCCCCC\C=C/CCCCCCCC)=O |
| SPLASH |
splash10-0a59-9200000000-e27551f5472625103e29 |
| Source of Spectrum |
Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |
| Synonyms |
(Z)-Docos-13-enoic acid |
