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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>25236-64-0更多圖譜> 2,2,2-三氟乙基甲磺酸酯(25236-64-0)質(zhì)譜(MS)

25236-64-0

2,2,2-三氟乙基甲磺酸酯(25236-64-0)質(zhì)譜(MS)

產(chǎn)品名稱:2,2,2-三氟乙基甲磺酸酯

CAS:25236-64-0

分子式:C3H5F3O3S

分子量: 178.13

InChI:InChI=1S/C3H5F3O3S/c1-10(7,8)9-2-3(4,5)6/h2H2,1H3

InChIKey: ICECLJDLAVVEOW-UHFFFAOYSA-N

Smiles:C(OS(C)(=O)=O)C(F)(F)F

  • 圖譜
    Mass 

    MS-IW-8106          
2,2,2-trifluoroethyl methanesulfonate
C3H5F3O3S           (Mass of molecular ion:    178)


       Source Temperature: 200 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV


          15.0      28.3
      29.0       5.5
      31.0       2.8
      33.0       3.8
      45.0       3.3
      48.0       2.1
      51.0       3.2
      63.0       5.6
      64.0       2.2
      65.0       3.5
      69.0       4.1
      78.0       1.1
      79.0     100.0
      80.0       3.8
      81.0       6.2
      83.0      10.7
     109.0      94.1
     110.0       2.9
     111.0       5.3
     159.0       1.9

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C3 H5 F3 O3 S 0.05 ml : 0.5 ml CDCl3
    2,2,2-trifluoroethyl methanesulfonate
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             4.542
      B             3.142
  

         Hz     ppm     Int.


       1827.39   4.573    130
   1819.34   4.553    364
   1811.40   4.533    370
   1803.34   4.513    142
   1255.98   3.143   1000

in CDCl3

  • 圖譜

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