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2-IODO-1-(5'-CYANOBENZIMIDAZOL-2'-YL)-BENZENE;2-(2-IODOPHENYL)-1H-BENZIMIDAZOLE-5-CARBONITRILE
SpectraBase Compound ID ICG95Uar5tc
InChI InChI=1S/C14H8IN3/c15-11-4-2-1-3-10(11)14-17-12-6-5-9(8-16)7-13(12)18-14/h1-7H,(H,17,18)
InChIKey VQBBGBBEQVGKKF-UHFFFAOYSA-N
Mol Weight 345.14 g/mol
Molecular Formula C14H8IN3
Exact Mass 344.976292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59jDFujG63V
Name 2-IODO-1-(5'-CYANOBENZIMIDAZOL-2'-YL)-BENZENE;2-(2-IODOPHENYL)-1H-BENZIMIDAZOLE-5-CARBONITRILE
Compound Number 3 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H8IN3
InChI InChI=1S/C14H8IN3/c15-11-4-2-1-3-10(11)14-17-12-6-5-9(8-16)7-13(12)18-14/h1-7H,(H,17,18)
InChIKey VQBBGBBEQVGKKF-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 345.142 g/mol
Solvent CDCl3+5-DROPS-CD3OD
Source File Reference UWVP5545