SpectraBase Spectrum ID |
AUNXW87HZ5f |
Name |
N-(2-Chlorophenyl)-3-fluorobenzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.035669776 u |
Formula |
C13H9ClFNO |
InChI |
InChI=1S/C13H9ClFNO/c14-11-6-1-2-7-12(11)16-13(17)9-4-3-5-10(15)8-9/h1-8H,(H,16,17) |
InChIKey |
MNXZEIANHIYULX-UHFFFAOYSA-N |
Molecular Weight |
249.672 g/mol |
SMILES |
C1(F)=CC(=CC=C1)C(=O)NC1=C(C=CC=C1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955377 |