SpectraBase Spectrum ID |
9HVSpacOcDe |
Name |
Benzamide, 3-chloro-N-(2,4,5-trichlorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
332.928174648 u |
Formula |
C13H7Cl4NO |
InChI |
InChI=1S/C13H7Cl4NO/c14-8-3-1-2-7(4-8)13(19)18-12-6-10(16)9(15)5-11(12)17/h1-6H,(H,18,19) |
InChIKey |
HBRYCKWBXZNPNM-UHFFFAOYSA-N |
Molecular Weight |
335.017 g/mol |
SMILES |
C1=C(C(=CC(=C1NC(=O)C1=CC(=CC=C1)Cl)Cl)Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962015 |