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3-BROMO-4-METHOXY-1-[5'-[5''-(4'''-METHYLPIPERAZIN-1'''-YL)-BENZIMIDAZOL-2''-YL]-BENZIMIDAZOL-2'-YL]-BENZENE
SpectraBase Compound ID 7xfKujArrMO
InChI InChI=1S/C26H25BrN6O/c1-32-9-11-33(12-10-32)18-5-7-21-23(15-18)31-26(29-21)17-3-6-20-22(14-17)30-25(28-20)16-4-8-24(34-2)19(27)13-16/h3-8,13-15H,9-12H2,1-2H3,(H,28,30)(H,29,31)
InChIKey NFHAFSYFANJGMA-UHFFFAOYSA-N
Mol Weight 517.43 g/mol
Molecular Formula C26H25BrN6O
Exact Mass 516.127322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3vuT1iRdNvs
Name 3-BROMO-4-METHOXY-1-[5'-[5''-(4'''-METHYLPIPERAZIN-1'''-YL)-BENZIMIDAZOL-2''-YL]-BENZIMIDAZOL-2'-YL]-BENZENE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H25BrN6O
InChI InChI=1S/C26H25BrN6O/c1-32-9-11-33(12-10-32)18-5-7-21-23(15-18)31-26(29-21)17-3-6-20-22(14-17)30-25(28-20)16-4-8-24(34-2)19(27)13-16/h3-8,13-15H,9-12H2,1-2H3,(H,28,30)(H,29,31)
InChIKey NFHAFSYFANJGMA-UHFFFAOYSA-N
Literature Reference Author D.P.KELLY,S.A.BATEMAN,R.J.HOOK,R.F.MARTIN,M.E.REUM,M.ROSE,A. R.D.WHITTAKER
Literature Reference Citation AUSTR.J.CHEM.,47,1751(1994)
Literature Reference DOI 10.1071/ch9941751
Molecular Weight 517.428 g/mol
Solvent CD3OD+AA
Source File Reference UWVP5538