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[1-[4-[4-[(4-amino-7-chloro-quinolin-1-ium-1-yl)methyl]phenyl]benzyl]-7-chloro-quinolin-1-ium-4-yl]amine dibromide
SpectraBase Compound ID Iv5GVUhWXio
InChI InChI=1S/C32H24Cl2N4.2BrH/c33-25-9-11-27-29(35)13-15-37(31(27)17-25)19-21-1-5-23(6-2-21)24-7-3-22(4-8-24)20-38-16-14-30(36)28-12-10-26(34)18-32(28)38;;/h1-18,35-36H,19-20H2;2*1H
InChIKey BGAHIISZJMSUNF-UHFFFAOYSA-N
Mol Weight 697.302 g/mol
Molecular Formula C32H26Br2Cl2N4
Exact Mass 693.990128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQZolC9TFD0
Name [1-[4-[4-[(4-amino-7-chloro-quinolin-1-ium-1-yl)methyl]phenyl]benzyl]-7-chloro-quinolin-1-ium-4-yl]amine dibromide
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H26Br2Cl2N4
InChI InChI=1S/C32H24Cl2N4.2BrH/c33-25-9-11-27-29(35)13-15-37(31(27)17-25)19-21-1-5-23(6-2-21)24-7-3-22(4-8-24)20-38-16-14-30(36)28-12-10-26(34)18-32(28)38;;/h1-18,35-36H,19-20H2;2*1H
InChIKey BGAHIISZJMSUNF-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 697.299 g/mol
Solvent DMSO-D6
Source File Reference UWLU36463