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网站主页CAS数据库列表 501-00-8更多图谱3-氟苯乙腈(501-00-8)核磁图(13CNMR)

3-氟苯乙腈

产品名称 3-氟苯乙腈

CAS号501-00-8

分子式C8H6FN

分子量135.14

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  • Mass

    MS-NW-9439          
    m-fluorophenylacetonitrile
    C8H6FN              (Mass of molecular ion:    135)
    

       Source Temperature: 250 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          31.0       1.3
          38.0       1.4
          39.0       2.8
          50.0       3.3
          51.0       2.5
          57.0       6.4
          61.0       1.5
          62.0       2.7
          63.0       3.5
          64.0       1.3
          67.5       2.3
          68.0       1.7
          69.0       1.9
          74.0       1.8
          75.0       6.0
          76.0       1.2
          81.0       3.7
          82.0       1.9
          83.0       4.3
          87.0       1.4
          88.0       2.1
          89.0       2.0
          94.0       1.0
          95.0       4.1
         106.0       1.4
         107.0      28.6
         108.0      50.4
         109.0      10.3
         114.0       1.3
         115.0      15.9
         116.0       2.6
         132.0       1.0
         134.0      48.0
         135.0     100.0
         136.0       8.9
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C8 H6 F N 0.05 ml : 0.5 ml CDCl3
    m-fluorophenylacetonitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.330 B 7.106 C 7.04 D 7.01 E 3.735

         Hz     ppm     Int.
    

       2942.02   7.362    106
       2936.04   7.347    110
       2933.96   7.342    211
       2927.98   7.327    212
       2926.15   7.322    143
       2920.29   7.308    131
       2844.73   7.119    184
       2843.75   7.116    226
       2843.02   7.114    237
       2842.29   7.112    182
       2837.04   7.099    153
       2836.06   7.097    189
       2835.33   7.095    207
       2834.59   7.093    159
       2817.75   7.051     93
       2815.92   7.046    179
       2815.19   7.045    169
       2814.45   7.043    143
       2814.09   7.042    143
       2813.48   7.040    124
       2812.62   7.038    119
       2812.01   7.037    141
       2811.52   7.035    137
       2808.96   7.029    127
       2808.47   7.028    124
       2806.52   7.023    184
       2805.79   7.021    177
       2803.96   7.017    254
       2803.47   7.015    253
       2801.27   7.010    123
       2800.90   7.009    127
       2795.29   6.995    100
       2794.80   6.994     99
       2792.72   6.988     73
       2792.24   6.987     70
       1492.80   3.736   1000
    

in CDCl3