SpectraBase Spectrum ID |
8IAqzk4UjMe |
Name |
N,N-Bis(4-bromobenzyl)-3-methylaniline |
Classification |
Chemical |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
442.988425616 u |
Formula |
C21H19Br2N |
InChI |
InChI=1S/C21H19Br2N/c1-16-3-2-4-21(13-16)24(14-17-5-9-19(22)10-6-17)15-18-7-11-20(23)12-8-18/h2-13H,14-15H2,1H3 |
InChIKey |
HLNPMCVHYDJUOK-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
445.198 g/mol |
Nominal Mass |
443 u |
Quality |
1000 |
Retention Index |
2906 |
SMILES |
C=1(N(CC=2C=CC(=CC2)Br)CC=2C=CC(=CC2)Br)C=C(C=CC1)C |
SPLASH |
splash10-00xu-4930300000-6fdf82596f6779c553f7 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N,N-bis[(4-bromophenyl)methyl]-3-methylaniline |
Technique |
GC/MS |
Wiley ID |
DD2024_028228 |