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N-Methylpyrazole

Compound with spectra: 115 NMR, 3 FTIR, 1 Raman, and 4 MS (GC)

N-Methylpyrazole
SpectraBase Compound ID LXxBnc0zeAj
InChI InChI=1S/C4H6N2/c1-6-4-2-3-5-6/h2-4H,1H3
InChIKey UQFQONCQIQEYPJ-UHFFFAOYSA-N
Mol Weight 82.11 g/mol
Molecular Formula C4H6N2
Exact Mass 82.053098 g/mol

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Chloroform-d

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13C NMR Spectrum
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Solvent CDCL3

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13C NMR Spectrum
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Solvent Dioxane

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13C NMR Spectrum
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Solvent CH2Cl2

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent Neat liquid

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent Dioxane

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13C NMR Spectrum
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Solvent CH2Cl2

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
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Solvent Dioxane

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13C NMR Spectrum
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Solvent CH2Cl2

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
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Solvent Dioxane

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13C NMR Spectrum
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Solvent CH2Cl2

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
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Solvent Dioxane

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13C NMR Spectrum
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Solvent CH2Cl2

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
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Solvent Dioxane

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CH2Cl2

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent Dioxane

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CH2Cl2

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent Neat liquid

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent NEAT

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent HMPTA

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent HEXANE

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CYClOHEXANE

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CH2Cl2

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DIOXANE-D8

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent PYRIDINE-D5

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent HMPA

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ET3N

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent BU3N

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CF3CH2OH

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13C NMR Spectrum
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Solvent NEAT

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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1H NMR Spectrum
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Polysol

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1H NMR Spectrum
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CHCl3

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3;CR(ACAC)3

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15N NMR Spectrum
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Solvent CHCl3

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent TFE

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CH3COOH

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACOH;TFA=2M

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15N NMR Spectrum
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Solvent HCl;PH=5.96

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15N NMR Spectrum
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Solvent HCl;PH=2.10

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15N NMR Spectrum
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Solvent HCl;PH=1.71

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15N NMR Spectrum
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Solvent HCl;PH=1.04

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15N NMR Spectrum
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Solvent HCl;PH=0.06

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15N NMR Spectrum
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Solvent NEAT

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15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent TFE

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15N NMR Spectrum
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Solvent DMSO-D6

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15N NMR Spectrum
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Solvent CHCl3

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15N NMR Spectrum
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Solvent CDCl3

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15N NMR Spectrum
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Solvent CDCl3

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15N NMR Spectrum
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Solvent DMSO

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15N NMR Spectrum
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Solvent DMSO

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15N NMR Spectrum
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Solvent CF3CH2OH

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15N NMR Spectrum
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Solvent CH3OH

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15N NMR Spectrum
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Solvent CH3COOH

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15N NMR Spectrum
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Solvent TFA

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15N NMR Spectrum
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Solvent CHCl3

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15N NMR Spectrum
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Solvent CHCl3

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15N NMR Spectrum
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Solvent CH3OH

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15N NMR Spectrum
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Solvent DMSO-D6

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15N NMR Spectrum
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Solvent CDCl3

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15N NMR Spectrum
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Solvent DMSO-D6

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15N NMR Spectrum
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Solvent CDCl3

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15N NMR Spectrum
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Solvent CDCl3

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15N NMR Spectrum
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Solvent CDCl3

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15N NMR Spectrum
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Solvent CDCl3

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Raman Spectrum
Copyright Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number L14831

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Catalog Number M969
Technique CAPILLARY CELL: NEAT

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FTIR Spectrum
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number L14831
Technique Neat

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ATR-IR Spectrum
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number L14831

View Spectrum of N-Methylpyrazole

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum O-3-1556-10

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MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum NP-0-543-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-218-0

View Spectrum of N-Methylpyrazole

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SRH-2022-455-0
  • 1-Methyl-1H-pyrazole
  • 1-Methylpyrazole
  • UQFQONCQIQEYPJ-UHFFFAOYSA-N
  • 1-METHYLPYRAZOL
  • N-METHYLPYRAZOL
  • 1-METHYL-PYRAZOLE;REFERENCES
  • N1-METHYL-PYRAZOLE
  • PYRAZOLE, 1-METHYL-,
  • 1H-pyrazole, 1-methyl-
1-Methylpyrazole
3-Deuterio-1-methylpyrazole
UQFQONCQIQEYPJ-VMNATFBRSA-N
3,4-Dideuterio-1-methylpyrazole
FLNMQGISZVYIIK-UHFFFAOYSA-N
NWHSSMRWECHZEP-UHFFFAOYSA-N
1-Ethynylpyrazole
1,2-DIMETHYLPYRAZOLE
PYRAZOLE-CH3I-SALT
PGNUBDXGTOZIHC-UHFFFAOYSA-N
4-Iodo-1-methyl-1H-pyrazole
IXJSDKIJPVSPKF-UHFFFAOYSA-N
3-Amino-1-methyl-2-pyrazolium cation
3-Amino-1-methyl-1H-pyrazole
Title Journal or Book Year
On the accuracy of the GIAO-DFT calculation of15N NMR chemical shifts of the nitrogen-containing heterocycles - a gateway to better agreement with experiment at lower computational cost Magnetic Resonance in Chemistry 2014
1H,13C and15N NMR studies on adducts formation of rhodium(II) tetraacylates with some azoles in CDCl3 solution Magnetic Resonance in Chemistry 2008
NMR investigation of chlorophosphorylation products of N -vinylazoles Magnetic Resonance in Chemistry 2008
A robust method for determining1H-15N long-range correlations:15N optimized CIGAR-HMBC experiments Magnetic Resonance in Chemistry 2003
NMR spectra of nitrogen-containing compounds. Correlations between experimental and GIAO calculated data Magnetic Resonance in Chemistry 1999
Substituent effects on the15N NMR Parameters of Azoles Magnetic Resonance in Chemistry 1997
Synthesis and13C NMR study of someN-substituted 4-iodo- and 3,4-diiodopyrazoles Journal of Heterocyclic Chemistry 1995
13C NMR of pyrazoles Magnetic Resonance in Chemistry 1993
Experimental (13C and15N NMR spectroscopy) and theoretical (6-31G) study of the protonation ofN-methylazoles andN-methylbenzazoles Magnetic Resonance in Chemistry 1993
High resolution 13C nuclear magnetic resonance spectra of solid pyrazoles. Application to annular tautomerism Canadian Journal of Chemistry 1988
Rearrangement of unsaturated acylhydroxybenzotriazoles The Journal of Organic Chemistry 1985
13C NMR chemical shifts ofN-unsubstituted- andN-methyl-pyrazole derivatives Organic Magnetic Resonance 1984
15N-NMR Spectra of Azoles with Two Heteroatoms Helvetica Chimica Acta 1983
Some INDO/SSOS calculations of the effects of hydrogen bonding on the nitrogen shielding of some heterocycles Organic Magnetic Resonance 1983
Nitrogen-15 NMR spectroscopy: prototropic tautomerism of azoles The Journal of Organic Chemistry 1982
Nitrogen-15 nuclear magnetic resonance spectroscopy. Effects of hydrogen bonding and protonation on nitrogen chemical shifts of pyrazoles The Journal of Organic Chemistry 1979
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
Etudes d'Hétérocycles Pentagonaux Polyhétéroatomiques par RMN du13C. Effets de Substituant, de la Benzocondensation et Etude de la Tautomèrie Prototropique en Série Benzothiazolique Organic Magnetic Resonance 1978

This compound is available in the following databases:

KnowItAll NMR Spectral Library
Author: Wiley

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KnowItAll IR, Raman, and UV-Vis Spectral Libraries
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The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.

KnowItAll Mass Spectral Library
Author: Wiley

The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.

1-Methylpyrazole
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.