| SpectraBase Spectrum ID |
CcfMynXmbuU |
| Name |
N,N'-bis(2-Chloro-4-nitrophenyl)terephthalamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
474.013389516 u |
| Formula |
C20H12Cl2N4O6 |
| InChI |
InChI=1S/C20H12Cl2N4O6/c21-15-9-13(25(29)30)5-7-17(15)23-19(27)11-1-2-12(4-3-11)20(28)24-18-8-6-14(26(31)32)10-16(18)22/h1-10H,(H,23,27)(H,24,28) |
| InChIKey |
ASJLYJVHWHXKHP-UHFFFAOYSA-N |
| Molecular Weight |
475.244 g/mol |
| SMILES |
C1(N(=O)=O)=CC(Cl)=C(C=C1)NC(=O)C1=CC=C(C=C1)C(=O)NC1=C(Cl)C=C(N(=O)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949944 |
