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2-PHENYL-5-METHYL-PYRAZOL-5-IN-3,4-DION
SpectraBase Compound ID 2mhvoUHCaSo
InChI InChI=1S/C10H8N2O2/c1-7-9(13)10(14)12(11-7)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey WZHUUJNRNMODNQ-UHFFFAOYSA-N
Mol Weight 188.19 g/mol
Molecular Formula C10H8N2O2
Exact Mass 188.058578 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9urDzdKbLHR
Name 2-Phenyl-5-methyl-pyrazol-5-in-3,4-dione
CAS Registry Number 881-05-0
Comments REASSIGNED (P.WESSELMAN)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H8N2O2
InChI InChI=1S/C10H8N2O2/c1-7-9(13)10(14)12(11-7)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey WZHUUJNRNMODNQ-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