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网站主页CAS数据库列表 5425-44-5更多图谱2-苯基-1,3-二噻烷(5425-44-5)Raman光谱

2-苯基-1,3-二噻烷

产品名称 2-苯基-1,3-二噻烷

CAS号5425-44-5

分子式C10H12S2

分子量196.33


  • Mass

    MS-NW-7986          
    2-phenyl-1,3-dithiane
    C10H12S2            (Mass of molecular ion:    196)
    

       Source Temperature: 120 °C
       Sample Temperature:  80 °C
       Direct, 75 eV
    

          18.0       1.6
          27.0       2.1
          39.0       7.1
          41.0       6.5
          42.0       1.2
          44.0       1.1
          45.0      26.2
          46.0       9.4
          47.0       2.7
          50.0       1.7
          51.0       6.9
          52.0       1.4
          59.0       1.0
          62.0       1.2
          63.0       4.1
          64.0       1.0
          65.0       1.7
          69.0       2.5
          71.0       1.4
          73.0      10.6
          74.0      17.0
          75.0       2.8
          76.0       1.1
          77.0      14.3
          78.0      10.8
          79.0       1.4
          89.0       4.0
          90.0       1.0
          91.0      15.2
          92.0       1.3
          98.0       1.2
         103.0       1.1
         104.0       1.4
         105.0      26.1
         106.0       2.0
         107.0       2.4
         115.0       4.5
         116.0       4.4
         117.0      10.6
         118.0       1.4
         119.0       2.1
         121.0      61.5
         122.0      79.6
         123.0      14.7
         124.0       4.2
         129.0       2.8
         130.0       1.7
         131.0      34.8
         132.0       4.3
         134.0       2.3
         135.0      10.2
         136.0       2.7
         149.0       6.5
         153.0       8.0
         154.0       1.7
         155.0       1.0
         163.0       2.1
         195.0       1.3
         196.0     100.0
         197.0      12.8
         198.0       9.4
         199.0       1.2
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C10 H12 S2 0.045 g : 0.5 ml CDCl3
    2-phenyl-1,3-dithiane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.466 B 7.331 C 7.292 D 5.161 E 3.035 F 2.891 G 2.140 J 1.916

         Hz     ppm     Int.
    

       2989.26   7.480    408
       2987.30   7.475    577
       2985.47   7.471    177
       2982.30   7.463    331
       2980.59   7.459    685
       2979.61   7.456    645
       2977.05   7.450     89
       2939.21   7.355    205
       2937.38   7.350    273
       2935.55   7.346    132
       2932.98   7.339    130
       2932.62   7.338    129
       2930.54   7.333    844
       2929.08   7.330    320
       2924.68   7.319    279
       2923.34   7.315    578
       2919.92   7.307    293
       2918.33   7.303    536
       2916.75   7.299    282
       2914.06   7.292    150
       2911.25   7.285    370
       2907.96   7.277     81
       2905.52   7.271     72
       2904.05   7.267    114
       2902.71   7.264     56
       2062.87   5.162   1000
       1230.71   3.080    213
       1228.15   3.074    231
       1218.26   3.049    242
       1217.04   3.046    284
       1215.94   3.043    502
       1214.72   3.040    311
       1213.62   3.037    355
       1204.71   3.015    188
       1203.74   3.012    385
       1202.27   3.009    211
       1201.29   3.006    357
       1164.92   2.915    278
       1161.74   2.907    358
       1160.77   2.905    433
       1157.59   2.897    324
       1150.39   2.879    197
       1147.22   2.871    279
       1146.36   2.869    240
       1142.94   2.860    199
        870.61   2.179     44
        868.04   2.173     95
        866.09   2.168    107
        863.65   2.162    183
        861.21   2.155    110
        859.25   2.151     95
        856.57   2.144    102
        853.88   2.137    128
        852.05   2.132    154
        849.49   2.126    245
        847.05   2.120    144
        845.09   2.115    128
        842.53   2.109     59
        786.99   1.970     62
        783.94   1.962    129
        780.76   1.954     71
        774.66   1.939    104
        772.83   1.934     71
        771.48   1.931    243
        769.78   1.927    118
        768.55   1.924    120
        766.72   1.919     61
        762.21   1.908     64
        760.50   1.903     89
        759.16   1.900    127
        757.45   1.896    190
        756.10   1.892     77
        754.39   1.888     86
        748.17   1.873     47
        745.00   1.865     85
        741.94   1.857     44
    

in CDCl3



KBr disc



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