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网站主页CAS数据库列表 2392-68-9更多图谱3-氯异硫氰酸苯酯(2392-68-9)Raman光谱

3-氯异硫氰酸苯酯

产品名称 3-氯异硫氰酸苯酯

CAS号2392-68-9

分子式C7H4ClNS

分子量169.63

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  • Mass

    MS-NW-9686          
    m-chlorophenyl isothiocyanate
    C7H4ClNS            (Mass of molecular ion:    169)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          39.0       1.0
          50.0       5.0
          51.0       2.9
          61.0       1.0
          63.0       2.1
          64.0       1.2
          66.5       1.2
          73.0       1.1
          74.0       3.0
          75.0      17.3
          76.0       2.8
          84.5       4.3
          85.0       2.1
          85.5       1.6
          90.0       2.2
         102.0       1.6
         111.0      37.6
         112.0       2.6
         113.0      12.1
         125.0       3.2
         127.0       1.1
         133.0       1.7
         134.0       7.7
         135.0       1.0
         137.0       2.7
         142.0       1.7
         169.0     100.0
         170.0       8.9
         171.0      36.6
         172.0       3.2
         173.0       1.5
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C7 H4 Cl N S 0.05 ml : 0.5 ml CDCl3
    m-chlorophenyl isothiocyanate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.24 B 7.21 C 7.168 D 7.074

         Hz     ppm     Int.
    

       2908.20   7.277    223
       2900.15   7.257    653
       2897.58   7.251    171
       2892.33   7.238   1000
       2890.38   7.233    938
       2888.55   7.228    599
       2884.03   7.217    170
       2882.20   7.212    252
       2880.49   7.208    123
       2866.70   7.174    538
       2864.75   7.169    890
       2863.04   7.164    496
       2832.28   7.087    374
       2830.44   7.083    575
       2828.74   7.079    306
       2825.07   7.069    318
       2823.24   7.065    483
       2821.29   7.060    262
    

in CDCl3



liquid film