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3218-49-3

3,4-Dichlorophenylacetonitrile

Product Name 3,4-Dichlorophenylacetonitrile

CAS3218-49-3

MFC8H5Cl2N

MW186.04

More

  • 3218-49-3_ms
    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

  • 3218-49-3_1hnmr

    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

  • 3218-49-3_13cnmr

KBr disc

  • 3218-49-3_ir1_2

nujol mull

  • 3218-49-3_ir2

  • 3218-49-3_raman