SpectraBase Spectrum ID |
9auV6FRvayK |
Name |
4-Bromo-N-[4-bromo-2-(2-chlorobenzoyl)phenyl]benzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
490.892332328 u |
Formula |
C20H12Br2ClNO2 |
InChI |
InChI=1S/C20H12Br2ClNO2/c21-13-7-5-12(6-8-13)20(26)24-18-10-9-14(22)11-16(18)19(25)15-3-1-2-4-17(15)23/h1-11H,(H,24,26) |
InChIKey |
ZOLLMQQARCKROD-UHFFFAOYSA-N |
Molecular Weight |
493.582 g/mol |
SMILES |
C1=C(C=CC(=C1)Br)C(NC1=C(C=C(C=C1)Br)C(C1=CC=CC=C1Cl)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837368 |