| SpectraBase Spectrum ID |
Fcth8nD3UYe |
| Name |
4-Fluoro-2-trifluoromethylbenzamide, N-(3-chloro-4-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
335.013632363 u |
| Formula |
C14H7ClF5NO |
| InChI |
InChI=1S/C14H7ClF5NO/c15-11-6-8(2-4-12(11)17)21-13(22)9-3-1-7(16)5-10(9)14(18,19)20/h1-6H,(H,21,22) |
| InChIKey |
LPLTYCOMVJSMNK-UHFFFAOYSA-N |
| Molecular Weight |
335.661 g/mol |
| SMILES |
C1(=CC=C(C=C1Cl)NC(C1=C(C(F)(F)F)C=C(F)C=C1)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917342 |
