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4-Methyl-1,3-diphenyl-3-pyrazolin-5-one

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4-Methyl-1,3-diphenyl-3-pyrazolin-5-one
SpectraBase Compound ID DMLA1QCt8fS
InChI InChI=1S/C16H14N2O/c1-12-15(13-8-4-2-5-9-13)17-18(16(12)19)14-10-6-3-7-11-14/h2-11,17H,1H3
InChIKey JTHWVOLVSHJKAP-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C16H14N2O
Exact Mass 250.110613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWBJ2c9Ksnz
Name 4-Methyl-1,3-diphenyl-3-pyrazolin-5-one
CAS Registry Number 113307-35-0
Comments CHEMICAL SHIFT RANGE QUOTED FOR N-1 PHENYL GROUP
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H14N2O
InChI InChI=1S/C16H14N2O/c1-12-15(13-8-4-2-5-9-13)17-18(16(12)19)14-10-6-3-7-11-14/h2-11,17H,1H3
InChIKey JTHWVOLVSHJKAP-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference A.R. Katritzky, P. Barczynski, J. Chem. Soc. Perkin II 969 (1987).
NMR Standard CD3CN
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3CN