SpectraBase Spectrum ID |
Kr0MeGLZPEG |
Name |
3-Fluoro-5-trifluoromethylbenzamide, N-(3-chlorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.023054233 u |
Formula |
C14H8ClF4NO |
InChI |
InChI=1S/C14H8ClF4NO/c15-10-2-1-3-12(7-10)20-13(21)8-4-9(14(17,18)19)6-11(16)5-8/h1-7H,(H,20,21) |
InChIKey |
FLHXUYJCSRUYPA-UHFFFAOYSA-N |
Molecular Weight |
317.671 g/mol |
SMILES |
C1(=CC(=CC(=C1)F)C(=O)NC1=CC(=CC=C1)Cl)C(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878838 |