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594-43-4

甲基磺酸乙脂(594-43-4)質(zhì)譜(MS)

產(chǎn)品名稱:甲基磺酸乙脂

CAS:594-43-4

分子式:C3H8O2S

分子量: 108.16

InChI:InChI=1S/C3H8O2S/c1-3-6(2,4)5/h3H2,1-2H3

InChIKey: YBJCDTIWNDBNTM-UHFFFAOYSA-N

Smiles:CCS(C)(=O)=O

  • 圖譜
    Mass 

    MS-IW-8102          
ethyl methyl sulfone
C3H8O2S             (Mass of molecular ion:    108)


       Source Temperature: 210 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV


          15.0       7.0
      17.0       1.3
      18.0       5.9
      26.0       2.9
      27.0      29.9
      28.0       6.4
      29.0      77.6
      30.0       2.0
      31.0       3.8
      45.0       1.7
      47.0       1.1
      48.0       2.1
      50.0       1.9
      63.0       4.4
      64.0       1.8
      65.0      35.8
      67.0       1.7
      79.0       4.5
      80.0     100.0
      81.0       3.8
      82.0       5.2
      93.0      11.0
     108.0       9.2
     109.0       6.7

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C3 H8 O2 S 0.040 g : 0.05 ml CDCl3
    ethyl methyl sulfone
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             3.056
      B             2.906
      C             1.424
  

         Hz     ppm     Int.


       1233.28   3.086     71
   1232.67   3.085     73
   1225.71   3.067    215
   1225.22   3.066    222
   1218.26   3.049    223
   1217.65   3.047    231
   1210.82   3.030     80
   1210.21   3.029     82
   1161.38   2.906   1000
   1160.89   2.905    764
    576.90   1.444    462
    569.34   1.425    893
    561.89   1.406    468

in CDCl3

  • 圖譜

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