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N-(1H-BENZIMIDAZOL-2-YL-METHYL)-PYRIDINIUM-CHLORIDE
SpectraBase Compound ID LnvJiQLiAcw
InChI InChI=1S/C13H12N3.ClH/c1-4-8-16(9-5-1)10-13-14-11-6-2-3-7-12(11)15-13;/h1-9H,10H2,(H,14,15);1H/q+1;/p-1
InChIKey RQKBZUAZNOXXDJ-UHFFFAOYSA-M
Mol Weight 245.71 g/mol
Molecular Formula C13H12ClN3
Exact Mass 245.071975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E8fQ97Wn7zj
Name N-(1H-BENZIMIDAZOL-2-YL-METHYL)-PYRIDINIUM-CHLORIDE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12ClN3
InChI InChI=1S/C13H12N3.ClH/c1-4-8-16(9-5-1)10-13-14-11-6-2-3-7-12(11)15-13;/h1-9H,10H2,(H,14,15);1H/q+1;/p-1
InChIKey RQKBZUAZNOXXDJ-UHFFFAOYSA-M
Literature Reference Author E.ALCALDE,L.PEREZ-GARCIA,C.MIRAVITLLES,J.RIUS,E.VALENTI
Literature Reference Citation J.ORG.CHEM.,57,4829(1992)
Literature Reference DOI 10.1021/jo00044a014
Molecular Weight 245.711 g/mol
Solvent DMSO-D6
Source File Reference UWCS13721