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网站主页CAS数据库列表 629-40-3更多图谱1,6-二氰基己烷(629-40-3)核磁图(13CNMR)

1,6-二氰基己烷

产品名称 1,6-二氰基己烷

CAS号629-40-3

分子式C8H12N2

分子量136.19

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  • Mass

    MS-NW-1078          
    suberonitrile
    C8H12N2             (Mass of molecular ion:    136)
    

       Source Temperature: 240 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          15.0       2.1
          18.0       2.8
          26.0       3.1
          27.0      20.4
          28.0       3.9
          29.0      13.8
          30.0       1.4
          37.0       1.0
          38.0       2.2
          39.0      21.1
          40.0       5.8
          41.0      80.6
          42.0      25.2
          43.0       3.3
          50.0       1.2
          51.0       2.4
          52.0       4.1
          53.0       6.9
          54.0      40.3
          55.0      75.2
          56.0       4.2
          64.0       1.3
          65.0       1.4
          66.0       2.7
          67.0       6.7
          68.0      13.8
          69.0      42.4
          70.0       2.4
          79.0       3.2
          80.0       2.3
          81.0       3.5
          82.0      17.7
          83.0      16.8
          94.0       1.3
          96.0     100.0
          97.0       6.9
         107.0       1.3
         108.0       5.6
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C8 H12 N2 0.04 ml : 0.5 ml CDCl3
    suberonitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.37 B 1.69 C 1.56

         Hz     ppm     Int.
    

        220.06   2.458    202
        219.19   2.448    198
        218.81   2.444    199
        217.44   2.428    158
        217.13   2.425    159
        212.63   2.375   1000
        205.94   2.300    428
        155.69   1.739    159
        152.75   1.706    199
        151.13   1.688    209
        150.13   1.677    231
        148.56   1.659    191
        146.38   1.635    235
        145.94   1.630    243
        145.56   1.626    249
        144.88   1.618    252
        144.38   1.613    251
        143.88   1.607    249
        139.38   1.557    575
        138.44   1.546    505
        135.06   1.509    285
        133.63   1.493    192
    

in CDCl3



CCl4 solution



liquid film