20451-53-0

苯基乙烯基亚砜(20451-53-0)红外图谱(IR1)

产品名称:苯基乙烯基亚砜

CAS:20451-53-0

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

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

¹H NMR	399.65 MHz
C₈ H₈ O S	0.05 ml : 0.5 ml CDCl₃
phenyl vinyl sulfoxide

    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