SpectraBase Spectrum ID |
6xZ0GrBnQ2Y |
Name |
2-Chloro-N-[1-(2-chlorophenyl)ethyl]acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.021769377 u |
Formula |
C10H11Cl2NO |
InChI |
InChI=1S/C10H11Cl2NO/c1-7(13-10(14)6-11)8-4-2-3-5-9(8)12/h2-5,7H,6H2,1H3,(H,13,14) |
InChIKey |
KDQQUHDAQIQHCW-UHFFFAOYSA-N |
Molecular Weight |
232.110 g/mol |
SMILES |
C(Cl)C(=O)NC(C)C1=C(C=CC=C1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975091 |