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1,1'-[PROPANE-1,3-DIYLBIS-(BENZENE-1,4-DIYLMETHYLENE)]-BIS-[(4-PYRROLIDINO)-PYRIDINIUM]-DIBROMIDE
SpectraBase Compound ID 1FmMpWOZVZS
InChI InChI=1S/C35H42N4.2BrH/c1-2-21-38(20-1)34-16-24-36(25-17-34)28-32-12-8-30(9-13-32)6-5-7-31-10-14-33(15-11-31)29-37-26-18-35(19-27-37)39-22-3-4-23-39;;/h8-19,24-27H,1-7,20-23,28-29H2;2*1H/q+2;;/p-2
InChIKey XRTRTZVDVGIJJF-UHFFFAOYSA-L
Mol Weight 678.557 g/mol
Molecular Formula C35H42Br2N4
Exact Mass 676.177623 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YfDRB96QSv
Name 1,1'-[PROPANE-1,3-DIYLBIS-(BENZENE-1,4-DIYLMETHYLENE)]-BIS-[(4-PYRROLIDINO)-PYRIDINIUM]-DIBROMIDE
Compound Number 44
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H42Br2N4
InChI InChI=1S/C35H42N4.2BrH/c1-2-21-38(20-1)34-16-24-36(25-17-34)28-32-12-8-30(9-13-32)6-5-7-31-10-14-33(15-11-31)29-37-26-18-35(19-27-37)39-22-3-4-23-39;;/h8-19,24-27H,1-7,20-23,28-29H2;2*1H/q+2;;/p-2
InChIKey XRTRTZVDVGIJJF-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 678.553 g/mol
Solvent CD3OD
Source File Reference UWVN28483