| SpectraBase Spectrum ID |
BRJfxJzdhlu |
| Name |
bis(2-Chloro-5-nitroanilino)-methane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
356.007910214 u |
| Formula |
C13H10Cl2N4O4 |
| InChI |
InChI=1S/C13H10Cl2N4O4/c14-10-3-1-8(18(20)21)5-12(10)16-7-17-13-6-9(19(22)23)2-4-11(13)15/h1-6,16-17H,7H2 |
| InChIKey |
JWJLFUQTPBGEFP-UHFFFAOYSA-N |
| Molecular Weight |
357.153 g/mol |
| SMILES |
C=1(N(=O)=O)C=C(NCNC2=CC(N(=O)=O)=CC=C2Cl)C(=CC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937406 |
