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13231-81-7

3-METHYL-1-HEXANOL

Product Name 3-METHYL-1-HEXANOL

CAS13231-81-7

MFC7H16O

MW116.2

More

  • 13231-81-7_ms
    Mass

    MS-IW-9043          
    3-methyl-1-hexanol
    C7H16O              (Mass of molecular ion:    116)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       1.0
          18.0       3.8
          27.0      19.3
          28.0       4.5
          29.0      20.7
          31.0      19.2
          39.0      15.8
          40.0       2.8
          41.0      64.8
          42.0      22.8
          43.0      94.0
          44.0       4.6
          45.0       5.6
          46.0       2.2
          51.0       1.3
          53.0       4.7
          54.0       3.0
          55.0      96.0
          56.0      46.2
          57.0      14.4
          59.0       1.3
          67.0       3.2
          68.0       3.6
          69.0      81.6
          70.0     100.0
          71.0      16.7
          72.0       1.3
          73.0       1.1
          81.0       1.0
          83.0      13.8
          84.0       1.3
          85.0       2.0
          97.0       1.1
          98.0      14.5
          99.0       1.3
    

400 MHz in CDCl3

  • 13231-81-7_1hnmr

    1H NMR 399.65 MHz
    C7 H16 O 0.05 ml : 0.5 ml CDCl3
    3-methyl-1-hexanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.644 B 2.74 C 1.58 D *1 1.37 to 1.35 E *1 1.13 F 0.886 G 0.884

         Hz     ppm     Int.
    

       1101.20   2.756     96
       1096.31   2.744    216
       1091.31   2.731     91
        653.44   1.636     42
        648.19   1.622     65
        646.73   1.619     56
        645.75   1.616     51
        641.24   1.605     97
        640.50   1.603    103
        638.92   1.599     59
        635.38   1.590    101
        633.54   1.586    108
        630.37   1.578    116
        629.27   1.575    110
        628.54   1.573    109
        626.59   1.568    100
        624.51   1.563    115
        619.75   1.551     93
        614.38   1.538     49
        613.40   1.535     53
        612.30   1.533     46
        553.83   1.386    119
        548.58   1.373    119
        547.97   1.372    125
        546.39   1.368    149
        544.43   1.363     93
        542.60   1.358    111
        541.14   1.355    153
        540.53   1.353    152
        539.18   1.350    116
        535.28   1.340    112
        531.98   1.332    102
        529.91   1.326    154
        524.66   1.313    165
        523.19   1.310    160
        519.41   1.300    110
        517.94   1.296    136
        515.87   1.291    137
        514.53   1.288    109
        513.55   1.285    101
        512.21   1.282    143
        511.60   1.281    141
        508.67   1.273    128
        505.62   1.266    104
        500.49   1.253     95
        457.40   1.145     90
        454.35   1.137     73
        452.03   1.132     72
        449.83   1.126     88
        446.78   1.118     66
        444.46   1.113     70
        361.21   0.904    476
        356.45   0.892   1000
        354.13   0.887    928
        349.61   0.875    910
        346.80   0.868    523
    

in CDCl3

  • 13231-81-7_13cnmr

liquid film

  • 13231-81-7_ir1