| SpectraBase Spectrum ID |
9AtQfOdKxoX |
| Name |
2-[2'-(2""""-Bromo-4""""-chlorophenyl)ethyl]-4-chlorophenylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.953017790 u |
| Formula |
C14H12BrCl2N |
| InChI |
InChI=1S/C14H12BrCl2N/c15-13-8-12(17)4-3-9(13)1-2-10-7-11(16)5-6-14(10)18/h3-8H,1-2,18H2 |
| InChIKey |
VAMRCARMKCSNDR-UHFFFAOYSA-N |
| Molecular Weight |
345.067 g/mol |
| SMILES |
C1(=CC(Cl)=CC=C1CCC=1C(=CC=C(C1)Cl)N)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931291 |