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2-PHENYL-4-METHOXYCARBONYL-PYRAZOL-4-IN-3-ON

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2-PHENYL-4-METHOXYCARBONYL-PYRAZOL-4-IN-3-ON
SpectraBase Compound ID 5NgUnNgMQ1X
InChI InChI=1S/C11H10N2O3/c1-16-11(15)9-7-12-13(10(9)14)8-5-3-2-4-6-8/h2-7,12H,1H3
InChIKey SBPBHELBINVBDU-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C11H10N2O3
Exact Mass 218.069142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lq7eHVZeqXN
Name 2-Phenyl-4-methoxycarbonyl-pyrazol-4-in-3-one
CAS Registry Number 52128-78-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H10N2O3
InChI InChI=1S/C11H10N2O3/c1-16-11(15)9-7-12-13(10(9)14)8-5-3-2-4-6-8/h2-7,12H,1H3
InChIKey SBPBHELBINVBDU-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference M. Begtrup, Acta Chem. Scand. B28, 61 (1974).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3