| SpectraBase Spectrum ID |
kGgkCHkXaz |
| Name |
Methyl 2-hydroxy-3-octyl-4-(2'-thienyl)-6-(trifluoromethyl)-benzoate |
| Alternate Name(s) |
Methyl 2-hydroxy-3-octyl-4-(thiophen-2-yl)-6-(trifluoromethyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25F3O3S |
| InChI |
InChI=1S/C21H25F3O3S/c1-3-4-5-6-7-8-10-14-15(17-11-9-12-28-17)13-16(21(22,23)24)18(19(14)25)20(26)27-2/h9,11-13,25H,3-8,10H2,1-2H3 |
| InChIKey |
NTKUQSACJATQNM-UHFFFAOYSA-N |
| Molecular Weight |
414.483 g/mol |
| SMILES |
Oc1c(c(C(F)(F)F)cc(c1CCCCCCCC)-c1sccc1)C(=O)OC |
| SPLASH |
splash10-07cr-0091400000-fcb6091213cfd670f751 |
| Source of Spectrum |
F5-6-3550-10e |
| Wiley ID |
1733636 |
