| SpectraBase Spectrum ID |
HLMJ3OgWfuA |
| Name |
2-Fluoro-3-trifluoromethylbenzoic acid, 3-methylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.061692212 u |
| Formula |
C15H10F4O2 |
| InChI |
InChI=1S/C15H10F4O2/c1-9-4-2-5-10(8-9)21-14(20)11-6-3-7-12(13(11)16)15(17,18)19/h2-8H,1H3 |
| InChIKey |
TZNAAUIZNZOHCX-UHFFFAOYSA-N |
| Molecular Weight |
298.237 g/mol |
| SMILES |
CC1=CC=CC(=C1)OC(C1=C(C(=CC=C1)C(F)(F)F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80179 |
