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网站主页CAS数据库列表 124-12-9更多图谱正辛腈(124-12-9)核磁图(13CNMR)

正辛腈

产品名称 正辛腈

CAS号124-12-9

分子式C8H15N

分子量125.21

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  • Mass

    MS-IW-4030          
    octanenitrile
    C8H15N              (Mass of molecular ion:    125)
    

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

          26.0       1.1
          27.0      18.1
          28.0       6.4
          29.0      25.9
          30.0       2.5
          39.0      16.2
          40.0       3.2
          41.0      77.2
          42.0      16.4
          43.0      50.3
          44.0       2.9
          51.0       1.3
          52.0       1.6
          53.0       5.1
          54.0      60.5
          55.0      55.8
          56.0      12.2
          57.0      19.1
          58.0       1.2
          66.0       1.3
          67.0       5.5
          68.0      12.3
          69.0      48.3
          70.0       7.2
          71.0       4.0
          79.0       4.1
          80.0       1.6
          81.0       3.1
          82.0     100.0
          83.0      54.1
          84.0       4.6
          85.0       2.1
          93.0       2.6
          94.0       1.1
          96.0      61.6
          97.0      28.6
          98.0       2.4
         110.0      17.3
         111.0       1.4
         124.0       5.1
         126.0       2.2
         142.0       3.0
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C8 H15 N 0.05 ml : 0.5 ml CDCl3
    octanenitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.339 B 1.652 C 1.45 D 1.34 to 1.27 E 0.891

         Hz     ppm     Int.
    

        942.02   2.358    545
        939.33   2.351     64
        934.94   2.340   1000
        931.27   2.331     54
        927.73   2.322    560
        675.29   1.690    126
        668.21   1.672    304
        666.14   1.667     93
        660.64   1.654    357
        653.08   1.635    327
        645.87   1.617    154
        592.04   1.482     72
        585.21   1.465    163
        583.50   1.461    155
        578.13   1.447    216
        575.32   1.440    170
        572.39   1.433    144
        569.82   1.426    182
        562.62   1.408    101
        547.36   1.370     52
        544.19   1.362    105
        542.11   1.357     95
        537.72   1.346    216
        536.62   1.343    219
        535.16   1.340    213
        532.10   1.332    281
        528.56   1.323    406
        523.68   1.311    515
        520.26   1.302    716
        513.79   1.286    326
        507.45   1.270    131
        504.39   1.263     71
        502.56   1.258     61
        499.15   1.249     48
        363.16   0.909    384
        356.45   0.892    947
        349.37   0.875    395
    

in CDCl3



liquid film