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3,4-二氯苯乙腈

产品名称 3,4-二氯苯乙腈

CAS号3218-49-3

分子式C8H5Cl2N

分子量186.04

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  • Mass

    MS-NW-7993          
    (3,4-dichlorophenyl)acetonitrile
    C8H5Cl2N            (Mass of molecular ion:    185)
    

       Source Temperature: 110 °C
       Sample Temperature:  60 °C
       Direct, 75 eV
    

          18.0       1.1
          36.0       1.0
          37.0       1.7
          38.0       1.5
          39.0       2.7
          43.0       2.0
          49.0       1.2
          50.0       3.4
          51.0       1.2
          56.5       2.5
          57.0       1.2
          57.5       1.7
          61.0       3.4
          62.0       3.6
          63.0       4.4
          64.0       1.3
          73.0       4.2
          74.0       3.7
          74.5       3.7
          75.0       4.8
          75.5       1.2
          84.0       1.5
          85.0       1.4
          86.0       1.4
          87.0       3.1
          88.0       3.0
          89.0       1.5
          92.5       2.0
          93.5       1.5
          97.0       1.5
          99.0       1.3
         109.0       2.0
         114.0       5.9
         115.0       2.0
         123.0      10.9
         124.0       2.3
         125.0       3.8
         148.0       1.0
         150.0     100.0
         151.0       9.1
         152.0      31.8
         153.0       3.0
         157.0       1.3
         159.0       2.0
         184.0       3.2
         185.0      36.8
         186.0       5.3
         187.0      23.2
         188.0       2.4
         189.0       3.8
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C8 H5 Cl2 N 0.05 g : 0.5 ml CDCl3
    (3,4-dichlorophenyl)acetonitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.44 B 7.40 C 7.175 D 3.726

         Hz     ppm     Int.
    

        670.63   7.489    229
        668.56   7.465     48
        665.44   7.431    270
        663.38   7.408    398
        662.50   7.398    658
        658.44   7.352     52
        647.44   7.230    142
        646.75   7.222    238
        646.13   7.215    168
        645.31   7.206    153
        644.69   7.199    203
        643.56   7.186     96
        642.25   7.172     42
        639.06   7.136     82
        638.44   7.129    127
        637.06   7.114     88
        636.31   7.105    116
        635.69   7.098     79
        333.81   3.728   1000
        328.81   3.672     51
    

in CDCl3



KBr disc



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