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4-AMINO-5-[5'-(4-CHLOROPHENYL)-1H-PYRAZOL-3-YL]-2,6-DIMETHYLPYRIDAZIN-3(2H)-ONE
SpectraBase Compound ID J6qTsZnNGcp
InChI InChI=1S/C15H14ClN5O/c1-8-13(14(17)15(22)21(2)20-8)12-7-11(18-19-12)9-3-5-10(16)6-4-9/h3-7H,17H2,1-2H3,(H,18,19)
InChIKey APYIFUWUUOETCE-UHFFFAOYSA-N
Mol Weight 315.76 g/mol
Molecular Formula C15H14ClN5O
Exact Mass 315.088688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 23aIOxwtICS
Name 4-AMINO-5-[5'-(4-CHLOROPHENYL)-1H-PYRAZOL-3-YL]-2,6-DIMETHYLPYRIDAZIN-3(2H)-ONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H14ClN5O
InChI InChI=1S/C15H14ClN5O/c1-8-13(14(17)15(22)21(2)20-8)12-7-11(18-19-12)9-3-5-10(16)6-4-9/h3-7H,17H2,1-2H3,(H,18,19)
InChIKey APYIFUWUUOETCE-UHFFFAOYSA-N
Literature Reference Author V.D.PIAZ,G.CICIANI,S.CHIMICHI
Literature Reference Citation HETEROCYCLES,24,3143(1986)
Literature Reference DOI 10.3987/R-1986-11-3143
Molecular Weight 315.762 g/mol
Solvent DMSO-D6
Source File Reference UWRK2218