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13630-19-8

2-Methylbenzotrifluoride

Product Name 2-Methylbenzotrifluoride

CAS13630-19-8

MFC8H7F3

MW160.14

More

  • 13630-19-8_ms
    Mass

    MS-IW-8360          
    alpha,alpha,alpha-trifluoro-o-xylene
    C8H7F3              (Mass of molecular ion:    160)
    

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

          27.0       1.0
          38.0       1.5
          39.0       5.2
          50.0       2.7
          51.0       3.7
          57.0       2.0
          61.0       1.0
          62.0       2.6
          63.0       6.0
          64.0       1.2
          65.0       6.2
          69.0       2.2
          70.0       3.8
          75.0       3.0
          77.0       1.0
          81.0       1.0
          83.0       2.5
          87.0       1.1
          88.0       1.3
          89.0       4.6
          90.0       2.1
          91.0     100.0
          92.0       8.3
          95.0       1.6
          99.0       1.8
         101.0       1.8
         107.0       1.7
         109.0      11.7
         110.0       1.2
         113.0       1.1
         114.0       2.6
         119.0       5.2
         120.0       1.6
         127.0       1.3
         138.0       2.6
         139.0       3.4
         140.0      13.4
         141.0       9.3
         145.0       2.0
         158.0       2.0
         159.0      15.8
         160.0      65.5
         161.0       5.7
    

400 MHz in CDCl3

  • 13630-19-8_1hnmr

    1H NMR 399.65 MHz
    C8 H7 F3 0.05 ml : 0.5 ml CDCl3
    alpha,alpha,alpha-trifluoro-o-xylene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.593 B 7.396 C 7.26 D 7.25 E 2.477

         Hz     ppm     Int.
    

       3038.09   7.602    230
       3030.40   7.583    243
       2964.84   7.419     97
       2964.48   7.418     96
       2956.91   7.399    234
       2949.83   7.382    164
       2906.49   7.273    401
       2905.76   7.271    397
       2898.68   7.254    406
       2898.07   7.252    398
       2888.79   7.229    145
        990.84   2.480    961
        989.01   2.475   1000
    

in CDCl3

  • 13630-19-8_13cnmr

liquid film

  • 13630-19-8_ir1