SpectraBase Spectrum ID |
LgpG4ogKlDI |
Name |
N-(2,4-Dichloro-6-nitrophenyl)acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
247.975547458 u |
Formula |
C8H6Cl2N2O3 |
InChI |
InChI=1S/C8H6Cl2N2O3/c1-4(13)11-8-6(10)2-5(9)3-7(8)12(14)15/h2-3H,1H3,(H,11,13) |
InChIKey |
HMZLGAJIRGFBFR-UHFFFAOYSA-N |
Molecular Weight |
249.053 g/mol |
SMILES |
C1=C(C=C(C(=C1N(=O)=O)NC(=O)C)Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970593 |