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5-AMINO-3-(2-CHLOROETHYL)-3H-IMIDAZO-[4,5-B]-PYRIDINE-6-CARBONITRILE
SpectraBase Compound ID JODuPo5kNXa
InChI InChI=1S/C9H8ClN5/c10-1-2-15-5-13-7-3-6(4-11)8(12)14-9(7)15/h3,5H,1-2H2,(H2,12,14)
InChIKey HPFKIWZXUQJLHT-UHFFFAOYSA-N
Mol Weight 221.65 g/mol
Molecular Formula C9H8ClN5
Exact Mass 221.046823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bkc0roweq2x
Name 5-AMINO-3-(2-CHLOROETHYL)-3H-IMIDAZO-[4,5-B]-PYRIDINE-6-CARBONITRILE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8ClN5
InChI InChI=1S/C9H8ClN5/c10-1-2-15-5-13-7-3-6(4-11)8(12)14-9(7)15/h3,5H,1-2H2,(H2,12,14)
InChIKey HPFKIWZXUQJLHT-UHFFFAOYSA-N
Literature Reference Author R.CLAYTON,C.A.RAMSDEN
Literature Reference Citation J.HETCYCL.CHEM.,41,701(2004)
Literature Reference DOI 10.1002/jhet.5570410508
Molecular Weight 221.649 g/mol
Solvent DMSO-D6
Source File Reference UWLU22464