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返回ChemicalBook首页>CAS数据库列表>25236-64-0更多图谱> 2,2,2-三氟乙基甲磺酸酯(25236-64-0)核磁图(1HNMR)

25236-64-0

2,2,2-三氟乙基甲磺酸酯(25236-64-0)核磁图(1HNMR)

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

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    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

  • 图谱

    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

  • 图谱

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