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[7-chloro-1-[4-[2-[4-[(7-chloro-4-dimethylamino-quinolin-1-ium-1-yl)methyl]phenyl]ethyl]benzyl]quinolin-1-ium-4-yl]-dimethyl-amine dibromide
SpectraBase Compound ID 3QX4GSJBv2t
InChI InChI=1S/C38H38Cl2N4.2BrH/c1-41(2)35-19-21-43(37-23-31(39)15-17-33(35)37)25-29-11-7-27(8-12-29)5-6-28-9-13-30(14-10-28)26-44-22-20-36(42(3)4)34-18-16-32(40)24-38(34)44;;/h7-24H,5-6,25-26H2,1-4H3;2*1H/q+2;;/p-2
InChIKey GFFNMZZDHRGXPL-UHFFFAOYSA-L
Mol Weight 781.464 g/mol
Molecular Formula C38H38Br2Cl2N4
Exact Mass 778.084029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9oar3vzMWl6
Name [7-chloro-1-[4-[2-[4-[(7-chloro-4-dimethylamino-quinolin-1-ium-1-yl)methyl]phenyl]ethyl]benzyl]quinolin-1-ium-4-yl]-dimethyl-amine dibromide
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H38Br2Cl2N4
InChI InChI=1S/C38H38Cl2N4.2BrH/c1-41(2)35-19-21-43(37-23-31(39)15-17-33(35)37)25-29-11-7-27(8-12-29)5-6-28-9-13-30(14-10-28)26-44-22-20-36(42(3)4)34-18-16-32(40)24-38(34)44;;/h7-24H,5-6,25-26H2,1-4H3;2*1H/q+2;;/p-2
InChIKey GFFNMZZDHRGXPL-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 781.461 g/mol
Solvent DMSO-D6
Source File Reference UWLU36469