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网站主页CAS数据库列表 103-72-0更多图谱硫代异氰酸苯酯(103-72-0)Raman光谱

硫代异氰酸苯酯

产品名称 硫代异氰酸苯酯

CAS号103-72-0

分子式C7H5NS

分子量135.19

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  • Mass

    MS-NW-4736          
    phenyl isothiocyanate
    C7H5NS              (Mass of molecular ion:    135)
    

       Source Temperature: 220 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          18.0       1.4
          27.0       2.4
          28.0       4.9
          32.0       1.6
          37.0       2.0
          38.0       2.7
          39.0       4.0
          44.0       1.3
          45.0       1.2
          50.0       9.6
          51.0      27.5
          52.0       2.3
          62.0       1.2
          63.0       3.2
          64.0       3.6
          67.5       5.1
          70.0       1.4
          74.0       2.8
          75.0       2.9
          76.0       3.9
          77.0      68.1
          78.0       4.7
          90.0       1.3
          91.0       4.0
         103.0       2.3
         108.0       3.0
         134.0       1.1
         135.0     100.0
         136.0       9.1
         137.0       4.8
    

400 MHz in CDCl3

90 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C7 H5 N S 0.05 ml : 0.5 ml CDCl3
    phenyl isothiocyanate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.297 B 7.236 C 7.148

         Hz     ppm     Int.
    

       2927.73   7.326    133
       2926.76   7.324    252
       2925.42   7.320    383
       2923.71   7.316    206
       2920.04   7.307    294
       2918.46   7.303    889
       2916.75   7.299    554
       2912.11   7.287    380
       2910.64   7.283    749
       2908.08   7.277    168
       2898.93   7.254    271
       2897.58   7.251    484
       2896.24   7.247    317
       2892.46   7.238    188
       2890.14   7.232    498
       2887.70   7.226    140
       2884.16   7.217    120
       2882.81   7.214    201
       2881.47   7.210    104
       2862.67   7.163    736
       2861.21   7.160   1000
       2859.01   7.154    279
       2855.83   7.146    394
       2855.47   7.145    392
       2854.13   7.142    674
       2853.52   7.141    590
       2853.03   7.139    592
       2850.46   7.133    115
    


  • 1H NMR 89.56 MHz
    C7 H5 N S 0.04 ml : 0.5 ml CDCl3
    phenyl isothiocyanate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.40 to 7.10

         Hz     ppm     Int.
    

        666.75   7.445     43
        663.63   7.410     42
        662.88   7.402     97
        661.00   7.381     76
        659.94   7.369     85
        658.69   7.355    169
        658.06   7.348    130
        656.63   7.332    251
        655.19   7.316    186
        653.81   7.301    275
        652.81   7.290    774
        651.44   7.274    691
        651.00   7.269    887
        650.56   7.264   1000
        649.75   7.255    751
        649.06   7.248    412
        647.44   7.230    503
        646.25   7.216    879
        645.19   7.204    451
        644.25   7.194    185
        643.44   7.185    313
        642.25   7.172    324
        641.38   7.162    211
        640.81   7.156    205
        639.88   7.145    121
        637.94   7.124    250
        636.19   7.104    146
        635.38   7.095    116
        633.00   7.068     32
    

in CDCl3



liquid film