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Back ChemicalBook Home>CAS DataBase List>565-69-5More Spectrum> 2-METHYL-3-PENTANONE(565-69-5) 1H NMR

565-69-5

2-METHYL-3-PENTANONE(565-69-5) 1H NMR

Molecular FormulaC6H12O

Molecular Weight100.16

InChIInChI=1S/C6H12O/c1-4-6(7)5(2)3/h5H,4H2,1-3H3

InChIKey HYTRYEXINDDXJK-UHFFFAOYSA-N

SmilesCC(C)C(=O)CC

  • 2-METHYL-3-PENTANONE(565-69-5) <sup>1</sup>H NMR
    Mass

    MS-IW-9264          
    2-methyl-3-pentanone
    C6H12O              (Mass of molecular ion:    100)
    

       Source Temperature: 210 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          26.0       1.4
          27.0      11.6
          28.0       4.3
          29.0      39.2
          39.0       5.1
          41.0      14.2
          42.0       3.6
          43.0      66.3
          44.0       2.3
          55.0       1.6
          56.0       7.1
          57.0     100.0
          58.0       3.8
          67.0       1.1
          70.0       1.6
          71.0      17.7
          85.0       1.2
         100.0      18.8
         101.0       1.8
    

parameter in CDCl3

  • 2-METHYL-3-PENTANONE(565-69-5) <sup>1</sup>H NMR

    1H NMR 300 MHz
    C6 H12 O 0.05 ml : 0.5 ml CDCl3
    2-methyl-3-pentanone
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 2.625 D(C) 1.096 J(A,C) 6.9 D(B) 2.483 D(D) 1.045 J(B,D) 7.3

         Hz     ppm     Int.
    

        801.43   2.671     28
        794.53   2.648     69
        787.63   2.625     94
        780.73   2.602     73
        773.83   2.579     32
        755.95   2.520     75
        748.65   2.495    234
        741.34   2.471    241
        734.06   2.447     83
        332.23   1.107   1000
        325.34   1.084    970
        320.75   1.069    256
        313.45   1.045    490
        306.16   1.021    232
    

in CDCl3

  • 2-METHYL-3-PENTANONE(565-69-5) <sup>1</sup>H NMR

liquid film

  • 2-METHYL-3-PENTANONE(565-69-5) <sup>1</sup>H NMR

  • 2-METHYL-3-PENTANONE(565-69-5) <sup>1</sup>H NMR

2-METHYL-3-PENTANONE(565-69-5) 1H NMR Atlas of Related Products

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