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20451-53-0

苯基乙烯基亚砜(20451-53-0)质谱(MS)

分子式:C8H8OS

分子量: 152.21

InChI:InChI=1S/C8H8OS/c1-2-10(9)8-6-4-3-5-7-8/h2-7H,1H2

InChIKey: MZMJHXFYLRTLQX-UHFFFAOYSA-N

Smiles:C1(S(C=C)=O)=CC=CC=C1

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    Mass

    MS-NW-6081          
    phenyl vinyl sulfoxide
    C8H8OS              (Mass of molecular ion:    152)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          26.0       2.7
          27.0      10.6
          28.0       1.8
          37.0       1.2
          38.0       1.9
          39.0       7.5
          45.0       7.8
          49.0       1.0
          50.0      11.8
          51.0      32.1
          52.0       3.2
          53.0       3.4
          57.0       1.1
          58.0       3.6
          59.0       9.6
          61.0       1.1
          62.0       1.2
          63.0       2.3
          65.0      12.8
          66.0       3.4
          69.0       4.5
          74.0       4.2
          75.0       3.2
          76.0       2.2
          77.0      34.8
          78.0      43.0
          79.0       4.7
          81.0       2.1
          82.0       1.2
          91.0      10.4
          92.0       1.3
          93.0       1.2
          94.0       3.2
          97.0      13.4
          98.0       1.0
         103.0       5.9
         104.0     100.0
         105.0       9.6
         107.0       1.2
         108.0       1.9
         109.0      33.5
         110.0       6.2
         111.0       2.0
         119.0       1.5
         123.0      16.6
         124.0       3.0
         125.0      18.3
         126.0       3.9
         127.0       1.2
         134.0       1.8
         135.0       8.7
         136.0       4.9
         137.0       1.1
         152.0      14.9
         153.0       1.9
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C8 H8 O S 0.05 ml : 0.5 ml CDCl3
    phenyl vinyl sulfoxide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.615 B 7.49 C 6.601 D 6.186 E 5.873

         Hz     ppm     Int.
    

       3048.83   7.629    568
       3046.63   7.624    421
       3044.56   7.619    268
       3043.58   7.616    283
       3042.85   7.614    295
       3040.89   7.609    713
       3039.18   7.605    673
       3036.13   7.597     93
       3032.59   7.589     36
       3005.98   7.522    126
       3004.27   7.518     86
       3001.83   7.512    231
       3000.24   7.508    208
       2997.31   7.500    646
       2996.70   7.499    651
       2995.12   7.495    379
       2993.65   7.491    422
       2991.21   7.485    935
       2989.50   7.481   1000
       2986.57   7.473    258
       2984.50   7.468    148
       2981.32   7.460     30
       2979.86   7.457     54
       2978.27   7.453     51
       2651.86   6.636    413
       2642.21   6.612    445
       2635.38   6.595    503
       2625.85   6.571    515
       2479.74   6.205    826
       2463.26   6.164    697
       2351.93   5.885    777
       2342.29   5.861    742
    

in CDCl3

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liquid film

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