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网站主页CAS数据库列表 76-00-6更多图谱1,1,1-TRICHLORO-2-PROPANOL(76-00-6)质谱(MS)

1,1,1-TRICHLORO-2-PROPANOL

产品名称 1,1,1-TRICHLORO-2-PROPANOL

CAS号76-00-6

分子式C3H5Cl3O

分子量163.43

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  • Mass

    MS-NW-6844          
    1,1,1-trichloro-2-propanol
    C3H5Cl3O            (Mass of molecular ion:    162)
    

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

          15.0       2.3
          19.0       3.7
          26.0       1.3
          27.0      13.4
          28.0       1.1
          29.0       5.1
          36.0       2.1
          39.0       1.6
          42.0       1.0
          43.0       7.8
          45.0     100.0
          46.0       2.4
          47.0       2.3
          48.0       1.7
          49.0       1.5
          63.0      11.7
          65.0       3.9
          82.0       2.0
          83.0       4.2
          84.0       1.4
          85.0       2.8
          91.0       9.1
          93.0       3.1
         111.0       2.9
         112.0       1.1
         113.0       1.8
         127.0       3.4
         129.0       2.0
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C3 H5 Cl3 O 0.048 g : 0.5 ml CDCl3
    1,1,1-trichloro-2-propanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.276 B 2.844 C 1.531 J(A,B)=5.5HZ J(A,C)=6.0HZ

         Hz     ppm     Int.
    

        394.94   4.410     26
        388.94   4.343     87
        386.44   4.315     24
        383.19   4.279    128
        379.56   4.239     25
        379.06   4.233     29
        377.25   4.213     96
        371.25   4.146     30
        257.31   2.874    144
        254.69   2.844     44
        251.75   2.811    135
        140.00   1.564   1000
        137.31   1.534     79
        133.94   1.496    958
        131.31   1.467     48
        130.31   1.456     34
    

in CDCl3



KBr disc



nujol mull



4880 A,200 M,powder