| SpectraBase Spectrum ID |
jk8kHXcCJc |
| Name |
1-Methylbutyl 2-(trifluoromethyl)benzoate |
| Alternate Name(s) |
2-Trifluoromethylbenzoic acid, 2-pentyl ester
2-(trifluoromethyl)benzoic acid pentan-2-yl ester
Pentan-2-yl 2-(trifluoromethyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15F3O2 |
| InChI |
InChI=1S/C13H15F3O2/c1-3-6-9(2)18-12(17)10-7-4-5-8-11(10)13(14,15)16/h4-5,7-9H,3,6H2,1-2H3 |
| InChIKey |
NFCWJRZDPRVTAQ-UHFFFAOYSA-N |
| Molecular Weight |
260.256 g/mol |
| SMILES |
c1(ccccc1C(OC(CCC)C)=O)C(F)(F)F |
| SPLASH |
splash10-00di-6900000000-383b0e26f0f3f88096b2 |
| Source of Spectrum |
NP-7-7006-0 |
| Wiley ID |
1106752 |
