| SpectraBase Spectrum ID |
BFa4chBsWaG |
| Name |
1-Methylheptyl 3-(trifluoromethyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21F3O2 |
| InChI |
InChI=1S/C16H21F3O2/c1-3-4-5-6-8-12(2)21-15(20)13-9-7-10-14(11-13)16(17,18)19/h7,9-12H,3-6,8H2,1-2H3 |
| InChIKey |
QFOMYXCNGAZYHR-UHFFFAOYSA-N |
| Molecular Weight |
302.337 g/mol |
| SMILES |
c1cc(C(OC(C)CCCCCC)=O)cc(c1)C(F)(F)F |
| SPLASH |
splash10-00di-3900000000-21e9797cf4d60e32af32 |
| Source of Spectrum |
NP-10-2107-0 |
| Synonyms |
3-Trifluoromethylbenzoic acid, 2-octyl ester
3-(trifluoromethyl)benzoic acid octan-2-yl ester
Octan-2-yl 3-(trifluoromethyl)benzoate |
| Wiley ID |
1108737 |
