| SpectraBase Spectrum ID |
8Fp3erG0hxg |
| Name |
Ethyl-3-trifluoromethyl benzoate |
| CAS Registry Number |
76783-59-0 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
218.055464017 u |
| Formula |
C10H9F3O2 |
| InChI |
InChI=1S/C10H9F3O2/c1-2-15-9(14)7-4-3-5-8(6-7)10(11,12)13/h3-6H,2H2,1H3 |
| InChIKey |
MHNBTKIAHHECCQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
218.175 g/mol |
| Nominal Mass |
218 u |
| Quality |
991 |
| Retention Index |
1136 |
| SMILES |
C(C1=CC(C(OCC)=O)=CC=C1)(F)(F)F |
| SPLASH |
splash10-006t-6900000000-268c4e740de571c7c90f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
ethyl 3-(trifluoromethyl)benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004466 |
