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2-碘三氟甲基苯

产品名称 2-碘三氟甲基苯

CAS号444-29-1

分子式C7H4F3I

分子量272.01

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  • Mass

    MS-NW-8810          
    alpha,alpha,alpha-trifluoro-o-iodotoluene
    C7H4F3I             (Mass of molecular ion:    272)
    

       Source Temperature: 280 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          39.0       1.2
          50.0       7.5
          51.0       2.3
          57.0       1.8
          69.0       3.9
          74.0       4.7
          75.0      12.3
          76.0       3.7
          94.0       1.8
          95.0      17.0
          96.0       1.1
          99.0       2.4
         119.0       1.7
         125.0       9.9
         126.0       4.6
         127.0       2.9
         136.0       2.8
         143.0       1.6
         144.0       2.5
         145.0      87.4
         146.0       6.7
         253.0       4.9
         272.0     100.0
         273.0       7.6
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C7 H4 F3 I 0.05 ml : 0.5 ml CDCl3
    alpha,alpha,alpha-trifluoro-o-iodotoluene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.990 B 7.614 C 7.410 D 7.165 CONFIRMED BY LAOCN PROGRAM

         Hz     ppm     Int.
    

        720.50   8.045    674
        720.00   8.040    731
        719.31   8.032    678
        716.19   7.997    142
        712.38   7.955    876
        712.06   7.951    870
        704.44   7.866     53
        704.00   7.861     52
        692.25   7.730     51
        688.31   7.686    445
        686.44   7.665    489
        680.50   7.599    993
        680.06   7.594    865
        678.56   7.577   1000
        674.25   7.529    134
        671.88   7.503    405
        671.25   7.495    490
        670.56   7.488    498
        669.88   7.480    405
        664.63   7.422    689
        663.88   7.413    833
        663.31   7.407    817
        662.63   7.399    662
        656.88   7.335    390
        656.19   7.327    457
        655.50   7.320    429
        654.75   7.311    336
        652.63   7.288    112
        652.06   7.281    114
        649.19   7.249    555
        648.63   7.243    567
        646.63   7.221    541
        641.38   7.162    676
        640.81   7.156    624
        639.56   7.142    617
        634.13   7.081    275
        633.50   7.074    284
        632.88   7.067    229
        632.19   7.059    251
        631.63   7.053    235
        629.25   7.027     59
    

in CDCl3



liquid film