| SpectraBase Spectrum ID |
4QhPp25ALj7 |
| Name |
1-[N,N-bis(2',4'-Dibromophenyl)amino]-2-bromo-4-nitrobenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
679.658092536 u |
| Formula |
C18H9Br5N2O2 |
| InChI |
InChI=1S/C18H9Br5N2O2/c19-10-1-4-16(13(21)7-10)24(17-5-2-11(20)8-14(17)22)18-6-3-12(25(26)27)9-15(18)23/h1-9H |
| InChIKey |
WTVFLWQPOBXHIM-UHFFFAOYSA-N |
| Molecular Weight |
684.802 g/mol |
| SMILES |
C=1(N(C=2C(=CC(=CC2)Br)Br)C=2C(=CC(=CC2)Br)Br)C(=CC(N(=O)=O)=CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.822384 |
![1-[N,N-bis(2',4'-Dibromophenyl)amino]-2-bromo-4-nitrobenzene](/api/spectrum/4QhPp25ALj7/structure.png?h=300&w=458 "1-[N,N-bis(2',4'-Dibromophenyl)amino]-2-bromo-4-nitrobenzene")
