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网站主页CAS数据库列表 402-45-9更多图谱对三氟甲基苯酚(402-45-9)质谱(MS)

对三氟甲基苯酚

产品名称 对三氟甲基苯酚

CAS号402-45-9

分子式C7H5F3O

分子量162.11

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  • Mass

    MS-NW-8820          
    p-(trifluoromethyl)phenol
    C7H5F3O             (Mass of molecular ion:    162)
    

       Source Temperature: 260 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          38.0       2.5
          39.0       6.5
          50.0       2.2
          51.0       1.6
          53.0       2.3
          56.0       1.0
          57.0       4.3
          62.0       2.1
          63.0       6.4
          64.0       2.0
          65.0       4.5
          69.0       1.7
          71.5       1.0
          74.0       1.0
          75.0       3.0
          81.0       2.2
          83.0       5.2
          84.0       2.8
          88.0       2.7
          89.0       1.1
          95.0       4.0
         112.0      27.7
         113.0       6.9
         114.0       7.7
         115.0       2.1
         132.0       1.4
         133.0       5.0
         141.0       1.0
         142.0       1.0
         143.0      48.0
         144.0       3.8
         145.0       3.2
         161.0       8.8
         162.0     100.0
         163.0       7.8
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C7 H5 F3 O 0.043 g : 0.5 ml DMSO-d6
    p-(trifluoromethyl)phenol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 10.29 B 7.529 C 6.952

         Hz     ppm     Int.
    

        927.76  10.360     31
        922.05  10.296   1000
        918.82  10.260     34
        685.69   7.657     27
        685.25   7.652     28
        679.69   7.590    391
        679.10   7.583    420
        675.29   7.541     91
        675.00   7.537     89
        670.75   7.490    563
        667.46   7.453     97
        628.78   7.021    141
        626.73   6.998    529
        626.07   6.991    559
        623.88   6.967    188
        621.75   6.943     85
        619.92   6.922    191
        617.80   6.899    438
        614.36   6.860     67
    

in DMSO-d6



KBr disc



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