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(5-CHLORO-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)-(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)-METHANONE
SpectraBase Compound ID AUMVHq8W5Q5
InChI InChI=1S/C21H17ClN4O2/c1-13-17(20(22)25(23-13)15-9-5-3-6-10-15)19(27)18-14(2)24-26(21(18)28)16-11-7-4-8-12-16/h3-12,28H,1-2H3
InChIKey FPNRXBPYWQILIK-UHFFFAOYSA-N
Mol Weight 392.85 g/mol
Molecular Formula C21H17ClN4O2
Exact Mass 392.104004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8cfoMAnxj6q
Name (5-CHLORO-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)-(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)-METHANONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H17ClN4O2
InChI InChI=1S/C21H17ClN4O2/c1-13-17(20(22)25(23-13)15-9-5-3-6-10-15)19(27)18-14(2)24-26(21(18)28)16-11-7-4-8-12-16/h3-12,28H,1-2H3
InChIKey FPNRXBPYWQILIK-UHFFFAOYSA-N
Literature Reference Author B.DATTERL,N.TROESTNER,D.KUCKARSKI,W.HOLZER
Literature Reference Citation MOLECULES,15,6106(2010)
Literature Reference DOI 10.3390/molecules15096106
Molecular Weight 392.845 g/mol
Sample ID 72409
Solvent CDCl3