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(4-chlorophenyl)-[1-[3-[3-[[4-[(4-chlorophenyl)-methyl-amino]quinolin-1-ium-1-yl]methyl]phenyl]benzyl]quinolin-1-ium-4-yl]-methyl-amine dibromide

View entire compound with spectra: 1 NMR

(4-chlorophenyl)-[1-[3-[3-[[4-[(4-chlorophenyl)-methyl-amino]quinolin-1-ium-1-yl]methyl]phenyl]benzyl]quinolin-1-ium-4-yl]-methyl-amine dibromide
SpectraBase Compound ID 8nRM8U4LTfA
InChI InChI=1S/C46H38Cl2N4.2BrH/c1-49(39-21-17-37(47)18-22-39)43-25-27-51(45-15-5-3-13-41(43)45)31-33-9-7-11-35(29-33)36-12-8-10-34(30-36)32-52-28-26-44(42-14-4-6-16-46(42)52)50(2)40-23-19-38(48)20-24-40;;/h3-30H,31-32H2,1-2H3;2*1H/q+2;;/p-2
InChIKey DVPNLNUQRDJCGC-UHFFFAOYSA-L
Mol Weight 877.552 g/mol
Molecular Formula C46H38Br2Cl2N4
Exact Mass 874.084029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EVdFbhktkr
Name (4-chlorophenyl)-[1-[3-[3-[[4-[(4-chlorophenyl)-methyl-amino]quinolin-1-ium-1-yl]methyl]phenyl]benzyl]quinolin-1-ium-4-yl]-methyl-amine dibromide
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H38Br2Cl2N4
InChI InChI=1S/C46H38Cl2N4.2BrH/c1-49(39-21-17-37(47)18-22-39)43-25-27-51(45-15-5-3-13-41(43)45)31-33-9-7-11-35(29-33)36-12-8-10-34(30-36)32-52-28-26-44(42-14-4-6-16-46(42)52)50(2)40-23-19-38(48)20-24-40;;/h3-30H,31-32H2,1-2H3;2*1H/q+2;;/p-2
InChIKey DVPNLNUQRDJCGC-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 877.549 g/mol
Solvent DMSO-D6
Source File Reference UWLU36446