| SpectraBase Spectrum ID |
5FMPHvnQh6 |
| Name |
9,12-Octadecadienoic acid, 2-(methylthio)-, ethyl ester, (Z,Z)- |
| Alternate Name(s) |
Ethyl (9Z,12Z)-2-(methylsulfanyl)-9,12-octadecadienoate
Ethyl 2-methylthiolinoleate |
| CAS Registry Number |
54002-49-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H38O2S |
| InChI |
InChI=1S/C21H38O2S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(24-3)21(22)23-5-2/h9-10,12-13,20H,4-8,11,14-19H2,1-3H3/b10-9-,13-12- |
| InChIKey |
RTXMFAGKDLJPIN-UTJQPWESSA-N |
| Molecular Weight |
354.593 g/mol |
| SMILES |
C(=O)(C(SC)CCCCCC\C=C/C\C=C/CCCCC)OCC |
| SPLASH |
splash10-066r-9000000000-8640be3d8607ab6806ed |
| Source of Spectrum |
C-98-4901-0 |
| Wiley ID |
1344796 |
