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2,4-Dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one

View entire compound with spectra: 15 NMR, 7 FTIR, 2 Raman, and 12 MS (GC)

2,4-Dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one
SpectraBase Compound ID GAvAjSKuTu9
InChI InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey QELUYTUMUWHWMC-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C10H10N2O
Exact Mass 174.079313 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTtQvDAwpV6
Name 1-Phenyl-3-methyl-pyrazol-2-in-5-one
CAS Registry Number 89-25-8
Comments BRUKER HFX-13 N-15 ENRICHED COMPOUND
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H10N2O
InChI InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey QELUYTUMUWHWMC-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference G.E. Hawkes, E.W. Randall, J. Elguero, J. Chem. Soc. Perkin II 1024 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3