John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=3HyO9ZpXraH

(accessed ).

2-Methyl-3-pentanone

Compound with open access spectra: 15 NMR, 6 FTIR, 2 Raman, and 10 MS

2-Methyl-3-pentanone
SpectraBase Compound ID 3HyO9ZpXraH
InChI InChI=1S/C6H12O/c1-4-6(7)5(2)3/h5H,4H2,1-3H3
InChIKey HYTRYEXINDDXJK-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

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MS Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany

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MS Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum HE-1982-0-0

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum PR-852-0-0

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AA-0-254-1

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum VC-1981-342-0

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AD-0-1790-0

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum LQ-1992-1985-0

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum JZ-1992-3688-0

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MS Spectrum
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum IC-50-0-0

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Fluka AG, Buchs, Switzerland
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20

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13C NMR Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CCl4

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13C NMR Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CCl4

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13C NMR Spectrum
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2021 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 108707
Solvent CDCl3

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1H NMR Spectrum
Copyright Copyright © 2009-2021 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3

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1H NMR Spectrum
Copyright Copyright © 2021 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 108707
Solvent CDCl3

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17O NMR Spectrum
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown

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17O NMR Spectrum
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown

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17O NMR Spectrum
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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17O NMR Spectrum
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent not reported

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Raman Spectrum
Copyright Copyright © 2014-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories
Catalog Number 108707

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Raman Spectrum
Copyright Copyright © 2017-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2021 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 108707

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FTIR Spectrum
Copyright Copyright © 2015-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 108707
Technique Neat

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FTIR Spectrum
Copyright Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 108707
Technique Neat

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ATR-IR Spectrum
Copyright Copyright © 2014-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 108707

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ATR-IR Spectrum
Copyright Copyright © 2018-2021 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 108707

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Vapor Phase IR Spectrum
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.

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Vapor Phase IR Spectrum
Copyright Copyright © 2021 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 108707
  • Ethyl isopropyl ketone
  • 2-METHYL-PENTAN-3-ONE
  • 3-Pentanone, 2-methyl-
  • 2-Methyl-pentanone-3
1-Hydroxy-3-methyl-2-butanone
1-Bromo-3-methylbutan-2-one
4-Methyl-3-oxo-pentanenitrile
4-Methyl-3-hexanone
Methylisopropylketone
2-bromopentan-3-one
2-Hydroxypentan-3-one
2-Methyl-3-heptanone
1-Hydroxy-2-methylpentan-3-one
2,5-Dimethyl-3-hexanone
Title Journal or Book Year
17O and 13C nuclear magnetic resonance study of polyfluorinated carbonyl compounds Journal of Fluorine Chemistry 1987
Charge distributions and chemical effects. XXVI. Relationships between nuclear magnetic resonance shifts and atomic charges for 17O nuclei in ethers and carbonyl compounds Canadian Journal of Chemistry 1982
Résonance Magnétique Nucléaire de17O. Aldéhydes et cétones aliphatiques: additivité des effets de substitution et corrélation avec la13C-RMN Helvetica Chimica Acta 1976
Nuclear magnetic resonance spectroscopy. Use of carbon-13 spectra to establish configurations of oximes The Journal of Organic Chemistry 1974
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