| SpectraBase Spectrum ID |
IgbPC7QHAxA |
| Name |
Acetamide, N-(3-nitrophenyl)-2,2-dichloro- |
| 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/c9-7(10)8(13)11-5-2-1-3-6(4-5)12(14)15/h1-4,7H,(H,11,13) |
| InChIKey |
MJSNGWQBPBCMJV-UHFFFAOYSA-N |
| Molecular Weight |
249.053 g/mol |
| SMILES |
C(C(=O)NC1=CC=CC(=C1)N(=O)=O)(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871113 |
