SpectraBase Spectrum ID |
1VB8w86GHuH |
Name |
2-Bromo-4-(dimethylamino)-A-methylphenethylamine, dihydrochloride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.034189288 u |
Formula |
C11H18BrClN2 |
InChI |
InChI=1S/C11H17BrN2.ClH/c1-8(13)6-9-4-5-10(14(2)3)7-11(9)12;/h4-5,7-8H,6,13H2,1-3H3;1H |
InChIKey |
SSNKIAGBBAFCFL-UHFFFAOYSA-N |
Molecular Weight |
293.636 g/mol |
Nominal Mass |
292 u |
SMILES |
NC(CC1=C(C=C(N(C)C)C=C1)Br)C.Cl |
Spectrum/Structure Validation Score (Raman) |
0.868362 |