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3,5-双三氟甲基苄醇

产品名称 3,5-双三氟甲基苄醇

CAS号32707-89-4

分子式C9H6F6O

分子量244.13

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  • Mass

    MS-IW-8114          
    3,5-bis(trifluoromethyl)benzyl alcohol
    C9H6F6O             (Mass of molecular ion:    244)
    

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

          29.0       7.8
          30.0       1.1
          31.0       6.1
          39.0       1.3
          50.0       2.1
          51.0       2.7
          57.0       1.8
          62.0       1.4
          63.0       2.2
          69.0       9.4
          74.0       2.3
          75.0       7.5
          77.0       2.6
          78.0       1.4
          81.0       1.3
          87.0       1.9
          88.0       2.8
          93.0       1.1
          94.0       1.1
          95.0       2.7
          96.0       1.1
          99.0       2.5
         101.0       1.2
         107.0       1.9
         112.0       2.2
         119.0       1.2
         125.0       5.3
         126.0       2.3
         127.0      47.2
         128.0       3.8
         132.0       1.0
         137.0       1.8
         138.0       2.2
         143.0       3.6
         144.0       5.2
         145.0      15.8
         146.0       2.2
         147.0      10.8
         155.0      19.5
         156.0       3.1
         157.0       2.5
         158.0       2.4
         163.0       5.2
         164.0       1.8
         173.0       1.7
         175.0      59.8
         176.0       9.6
         177.0       5.7
         187.0       3.2
         190.0       1.1
         193.0       1.0
         194.0       4.2
         195.0     100.0
         196.0      26.7
         197.0       1.9
         205.0       1.5
         206.0       1.0
         207.0       1.5
         208.0       1.2
         213.0      11.9
         214.0       3.5
         215.0       4.9
         216.0       1.7
         223.0       6.1
         224.0       5.4
         225.0      43.3
         226.0       6.5
         227.0      10.2
         228.0       1.1
         241.0       5.7
         243.0      16.4
         244.0      53.2
         245.0       5.3
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C9 H6 F6 O 0.039 g : 0.5 ml CDCl3
    3,5-bis(trifluoromethyl)benzyl alcohol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.827 B 7.801 C 4.840 D 2.21

         Hz     ppm     Int.
    

       3128.30   7.828    684
       3117.80   7.802    305
       1934.33   4.841   1000
        881.96   2.207     40
    

in CDCl3



KBr disc



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