| SpectraBase Spectrum ID |
8AzUTjXm5W2 |
| Name |
Benzamide, 2-chloro-N-(2-fluorophenyl)- |
| 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/c14-10-6-2-1-5-9(10)13(17)16-12-8-4-3-7-11(12)15/h1-8H,(H,16,17) |
| InChIKey |
QKUIHGREZZXXGL-UHFFFAOYSA-N |
| Molecular Weight |
249.672 g/mol |
| SMILES |
C(C1=C(C=CC=C1)Cl)(=O)NC1=CC=CC=C1F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951301 |