| SpectraBase Spectrum ID |
EMW0SSIO0Ue |
| Name |
3-Fluoro-5-trifluoromethylbenzoic acid, phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.046042148 u |
| Formula |
C14H8F4O2 |
| InChI |
InChI=1S/C14H8F4O2/c15-11-7-9(6-10(8-11)14(16,17)18)13(19)20-12-4-2-1-3-5-12/h1-8H |
| InChIKey |
BQMZNYOYJDZWOD-UHFFFAOYSA-N |
| Molecular Weight |
284.210 g/mol |
| SMILES |
C1=C(C=C(C=C1C(F)(F)F)F)C(=O)OC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93202 |
