| SpectraBase Spectrum ID |
E0dXibjhtyO |
| Name |
5-Bromo-N-(4-chloro-phenyl)-2-cyclopropylcarbamoylmethoxy-benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
422.003283080 u |
| Formula |
C18H16BrClN2O3 |
| InChI |
InChI=1S/C18H16BrClN2O3/c19-11-1-8-16(25-10-17(23)21-13-6-7-13)15(9-11)18(24)22-14-4-2-12(20)3-5-14/h1-5,8-9,13H,6-7,10H2,(H,21,23)(H,22,24) |
| InChIKey |
VIUZZMBLQCAVAX-UHFFFAOYSA-N |
| Molecular Weight |
423.694 g/mol |
| SMILES |
C1(C(NC2=CC=C(C=C2)Cl)=O)=C(OCC(NC2CC2)=O)C=CC(=C1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.824631 |
