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1-Phenylpyrazole
SpectraBase Compound ID DwyerPfFiWY
InChI InChI=1S/C9H8N2/c1-2-5-9(6-3-1)11-8-4-7-10-11/h1-8H
InChIKey WITMXBRCQWOZPX-UHFFFAOYSA-N
Mol Weight 144.18 g/mol
Molecular Formula C9H8N2
Exact Mass 144.068748 g/mol
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
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Solvent CDCL3
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent Neat liquid
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Solvent HMPTA
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Solvent DMSO-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Solvent DMSO-D6
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Solvent DMSO-D6
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Solvent HMPA
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Solvent CDCl3
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Solvent CDCl3
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Solvent CDCl3
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Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 278289
Solvent CDCl3
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Solvent CDCl3
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Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 278289
Solvent CDCl3
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Solvent CDCl3
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Solvent C6D6
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Solvent DMSO
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Solvent DMSO-D6
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Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Technique CAPILLARY CELL: NEAT
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Solvent Methanol
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Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 278289
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 278289
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum W6-6547-0-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum EK-1999-692-0
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Source of Spectrum 0-16-380-3
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Source of Spectrum SRH-2022-2017-0
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Source of Spectrum C-129-12873-fig.2/cpd.11
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Source of Spectrum F-66-3482-b
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Source of Spectrum CN101260081B
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 278289
  • 1-Phenylpyrazol
  • WITMXBRCQWOZPX-UHFFFAOYSA-N
  • 1-phenyl-1H-pyrazole
  • PYRAZOLE, 1-PHENYL-,
  • N-Phenylpyrazole
  • 1H-PYRAZOLE, 1-PHENYL-
Title Journal or Book Year
Complete assignment of NMR data of 22 phenyl‐1H‐pyrazoles' derivatives Magnetic Resonance in Chemistry 2011
A robust method for determining 1H–15N long‐range correlations: 15N optimized CIGAR‐HMBC experiments Magnetic Resonance in Chemistry 2003
Substituent effects on the15N NMR Parameters of Azoles Magnetic Resonance in Chemistry 1997
13C NMR of pyrazoles Magnetic Resonance in Chemistry 1993
Research in the azole series. 103. Synthesis and 13C NMR study of pyrazole‐4‐carboxaldehydes Journal of Heterocyclic Chemistry 1993
The synthesis and unimolecular decomposition of four novel Δ1-1,2,4-triazolines Canadian Journal of Chemistry 1988
Etude en Résonance Magnétique Nucléaire du Carbone‐13 de Quelques Aminopyrazoles. Sur le Problème de la Détermination des Constantes d'Equilibre Tautomère Organic Magnetic Resonance 1979
13C-NMR Spectra of Phenyl-substituted Azoles: a Conformational Study. Acta Chemica Scandinavica 1973

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