| SpectraBase Spectrum ID |
379uFJGBknY |
| Name |
2-Fluoro-5-(trifluoromethyl)benzoic acid |
| CAS Registry Number |
161622-05-5 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
208.014742019 u |
| Formula |
C8H4F4O2 |
| InChI |
InChI=1S/C8H4F4O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14) |
| InChIKey |
LIFKXWNFWIUMJT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
208.112 g/mol |
| Nominal Mass |
208 u |
| Quality |
970 |
| Retention Index |
1152 |
| SMILES |
OC(C=1C(=CC=C(C(F)(F)F)C1)F)=O |
| SPLASH |
splash10-01ox-5920000000-a5d8f0d8a655c0e974f4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-fluoro-5-(trifluoromethyl)benzoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005453 |
