| SpectraBase Compound ID | 7du5QG0FMhE |
|---|---|
| InChI | InChI=1S/C7H4F4O/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3,12H |
| InChIKey | WEUIJSDNBZVSNY-UHFFFAOYSA-N |
| Mol Weight | 180.1 g/mol |
| Molecular Formula | C7H4F4O |
| Exact Mass | 180.019827 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 70nc6KNykan |
|---|---|
| Name | 2-Fluoro-4-(trifluoromethyl)phenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.019827400 u |
| Formula | C7H4F4O |
| InChI | InChI=1S/C7H4F4O/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3,12H |
| InChIKey | WEUIJSDNBZVSNY-UHFFFAOYSA-N |
| Molecular Weight | 180.102 g/mol |
| SMILES | C1=C(C(=CC(=C1)C(F)(F)F)F)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.832747 |