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[1-[4-[2-[4-[(4-amino-7-chloro-quinolin-1-ium-1-yl)methyl]phenyl]ethyl]benzyl]-7-chloro-quinolin-1-ium-4-yl]amine dibromide
SpectraBase Compound ID 8v9KtPE4L2q
InChI InChI=1S/C34H28Cl2N4.2BrH/c35-27-11-13-29-31(37)15-17-39(33(29)19-27)21-25-7-3-23(4-8-25)1-2-24-5-9-26(10-6-24)22-40-18-16-32(38)30-14-12-28(36)20-34(30)40;;/h3-20,37-38H,1-2,21-22H2;2*1H
InChIKey DGXIZUQYHONHRW-UHFFFAOYSA-N
Mol Weight 725.356 g/mol
Molecular Formula C34H30Br2Cl2N4
Exact Mass 722.021428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4JulFN3Xk19
Name [1-[4-[2-[4-[(4-amino-7-chloro-quinolin-1-ium-1-yl)methyl]phenyl]ethyl]benzyl]-7-chloro-quinolin-1-ium-4-yl]amine dibromide
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H30Br2Cl2N4
InChI InChI=1S/C34H28Cl2N4.2BrH/c35-27-11-13-29-31(37)15-17-39(33(29)19-27)21-25-7-3-23(4-8-25)1-2-24-5-9-26(10-6-24)22-40-18-16-32(38)30-14-12-28(36)20-34(30)40;;/h3-20,37-38H,1-2,21-22H2;2*1H
InChIKey DGXIZUQYHONHRW-UHFFFAOYSA-N
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 725.353 g/mol
Solvent DMSO-D6
Source File Reference UWLU36468