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1,1'-[METHYLENEBIS-(BENZENE-1,4-DIYLMETHYLENE)]-BIS-[(4-PYRROLIDINO)-PYRIDINIUM]-DIBROMIDE
SpectraBase Compound ID GSejx19xgnz
InChI InChI=1S/C33H38N4.2BrH/c1-2-18-36(17-1)32-13-21-34(22-14-32)26-30-9-5-28(6-10-30)25-29-7-11-31(12-8-29)27-35-23-15-33(16-24-35)37-19-3-4-20-37;;/h5-16,21-24H,1-4,17-20,25-27H2;2*1H/q+2;;/p-2
InChIKey LTIRDMTYCMHEFP-UHFFFAOYSA-L
Mol Weight 650.503 g/mol
Molecular Formula C33H38Br2N4
Exact Mass 648.146323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24uqalrG4mq
Name 1,1'-[METHYLENEBIS-(BENZENE-1,4-DIYLMETHYLENE)]-BIS-[(4-PYRROLIDINO)-PYRIDINIUM]-DIBROMIDE
Compound Number 52
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H38Br2N4
InChI InChI=1S/C33H38N4.2BrH/c1-2-18-36(17-1)32-13-21-34(22-14-32)26-30-9-5-28(6-10-30)25-29-7-11-31(12-8-29)27-35-23-15-33(16-24-35)37-19-3-4-20-37;;/h5-16,21-24H,1-4,17-20,25-27H2;2*1H/q+2;;/p-2
InChIKey LTIRDMTYCMHEFP-UHFFFAOYSA-L
Literature Reference Author J.M.CAMPOS,M.C.NUNEZ,R.M.SANCHEZ,J.A.GOMEZ-VIDAL,A.RODRIGUEZ -GONZALEZ,M.BANEZ,M.
Literature Reference Citation BIOORG.MED.CHEM.,10,2215(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00054-8
Molecular Weight 650.500 g/mol
Solvent CD3OD
Source File Reference UWVN28488