SpectraBase Spectrum ID |
BvgI2wkT3eQ |
Name |
4-Amino-1-(4-(benzyl(tert-butoxycarbonyl)amino)butyl)-7-chloroquinolinium bromide |
Appearance |
White crystals |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H31BrClN3O2 |
InChI |
InChI=1S/C25H30ClN3O2.BrH/c1-25(2,3)31-24(30)29(18-19-9-5-4-6-10-19)15-8-7-14-28-16-13-22(27)21-12-11-20(26)17-23(21)28;/h4-6,9-13,16-17,27H,7-8,14-15,18H2,1-3H3;1H |
InChIKey |
RYVOTRJINRWTEP-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT 8200 |
Ionization Type |
EI |
Molecular Weight |
520.899 g/mol |
SMILES |
Nc1cc[n+](c2c1ccc(c2)Cl)CCCCN(C(=O)OC(C)(C)C)Cc1ccccc1.[Br-] |
SPLASH |
splash10-004l-4900000000-13d6c771cb1277a8a84c |
Source of Spectrum |
WO2012041493A1 |
Wiley ID |
1845350 |