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[7-chloro-1-[4-[2-[4-[[7-chloro-4-(methyl-phenyl-amino)quinolin-1-ium-1-yl]methyl]phenyl]ethyl]benzyl]quinolin-1-ium-4-yl]-methyl-phenyl-amine dibromide

View entire compound with spectra: 1 NMR

[7-chloro-1-[4-[2-[4-[[7-chloro-4-(methyl-phenyl-amino)quinolin-1-ium-1-yl]methyl]phenyl]ethyl]benzyl]quinolin-1-ium-4-yl]-methyl-phenyl-amine dibromide
SpectraBase Compound ID 6tqlcmMLhEU
InChI InChI=1S/C48H42Cl2N4.2BrH/c1-51(41-9-5-3-6-10-41)45-27-29-53(47-31-39(49)23-25-43(45)47)33-37-19-15-35(16-20-37)13-14-36-17-21-38(22-18-36)34-54-30-28-46(44-26-24-40(50)32-48(44)54)52(2)42-11-7-4-8-12-42;;/h3-12,15-32H,13-14,33-34H2,1-2H3;2*1H/q+2;;/p-2
InChIKey CHARTEBAXLGGDS-UHFFFAOYSA-L
Mol Weight 905.606 g/mol
Molecular Formula C48H42Br2Cl2N4
Exact Mass 902.115329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7zrmzkskfwz
Name [7-chloro-1-[4-[2-[4-[[7-chloro-4-(methyl-phenyl-amino)quinolin-1-ium-1-yl]methyl]phenyl]ethyl]benzyl]quinolin-1-ium-4-yl]-methyl-phenyl-amine dibromide
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H42Br2Cl2N4
InChI InChI=1S/C48H42Cl2N4.2BrH/c1-51(41-9-5-3-6-10-41)45-27-29-53(47-31-39(49)23-25-43(45)47)33-37-19-15-35(16-20-37)13-14-36-17-21-38(22-18-36)34-54-30-28-46(44-26-24-40(50)32-48(44)54)52(2)42-11-7-4-8-12-42;;/h3-12,15-32H,13-14,33-34H2,1-2H3;2*1H/q+2;;/p-2
InChIKey CHARTEBAXLGGDS-UHFFFAOYSA-L
Literature Reference Author J.M.CAMPOS,R.M.SANCHEZ-MARTIN,O.CRUZ-LOPEZ,A.CONEJO-GARCIA,M .A.GALLO,A.ESPINOSA
Literature Reference Citation MAGN.RES.CHEM.,43,1066(2005)
Literature Reference DOI 10.1002/mrc.1659
Molecular Weight 905.602 g/mol
Solvent DMSO-D6
Source File Reference UWLU36471