| SpectraBase Spectrum ID |
8liyogzWdJ2 |
| Name |
1-Methylbutyl 3-(trifluoromethyl)benzoate |
| Alternate Name(s) |
3-Trifluoromethylbenzoic acid, 2-pentyl ester
3-(trifluoromethyl)benzoic acid pentan-2-yl ester
Pentan-2-yl 3-(trifluoromethyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15F3O2 |
| InChI |
InChI=1S/C13H15F3O2/c1-3-5-9(2)18-12(17)10-6-4-7-11(8-10)13(14,15)16/h4,6-9H,3,5H2,1-2H3 |
| InChIKey |
RNCSBBDJLNVXSR-UHFFFAOYSA-N |
| Molecular Weight |
260.256 g/mol |
| SMILES |
c1cc(C(OC(CCC)C)=O)cc(c1)C(F)(F)F |
| SPLASH |
splash10-00di-2900000000-006e6e31f0cb31d0176c |
| Source of Spectrum |
NP-7-7007-0 |
| Wiley ID |
1106753 |
