SpectraBase Spectrum ID |
2zWxZSDln7M |
Name |
3-Chloro-N-(2,5-dichlorophenyl)benzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
298.967146981 u |
Formula |
C13H8Cl3NO |
InChI |
InChI=1S/C13H8Cl3NO/c14-9-3-1-2-8(6-9)13(18)17-12-7-10(15)4-5-11(12)16/h1-7H,(H,17,18) |
InChIKey |
NGDJTIWSDZCCEE-UHFFFAOYSA-N |
Molecular Weight |
300.572 g/mol |
SMILES |
C1(Cl)=C(C=C(C=C1)Cl)NC(=O)C1=CC(=CC=C1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876362 |