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Back ChemicalBook Home>CAS DataBase List>1422-53-3More Spectrum> 2-Bromo-4-fluorotoluene(1422-53-3) 13C NMR

2-Bromo-4-fluorotoluene(1422-53-3) 13C NMR

Molecular FormulaC7H6BrF

Molecular Weight189.02

InChIInChI=1S/C7H6BrF/c1-5-2-3-6(9)4-7(5)8/h2-4H,1H3

InChIKey SFGFOJPGCOYQJK-UHFFFAOYSA-N

SmilesC1(C)=CC=C(F)C=C1Br


  • Mass

    MS-IW-9326          
    2-bromo-4-fluorotoluene
    C7H6BrF             (Mass of molecular ion:    188)
    

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

          31.0       3.0
          37.0       1.3
          38.0       1.9
          39.0       4.8
          43.0       1.6
          44.0       8.3
          50.0       4.5
          51.0       3.4
          54.0       2.8
          56.0       1.3
          57.0      10.3
          59.0       1.9
          61.0       2.5
          62.0       4.6
          63.0       7.2
          68.0       1.0
          74.0       1.7
          75.0       1.2
          80.0       1.7
          81.0       6.3
          82.0       2.4
          83.0      18.5
          84.0       3.5
          85.0       3.1
          86.0       1.3
          87.0       1.2
          89.0       3.0
          94.0       2.5
          95.0       2.0
         107.0      19.9
         108.0      22.6
         109.0     100.0
         110.0       7.8
         187.0       9.4
         188.0      48.8
         189.0      12.8
         190.0      47.2
         191.0       3.6
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C7 H6 Br F 0.05 ml : 0.5 ml CDCl3
    2-bromo-4-fluorotoluene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.236 B 7.131 C 6.886 D 2.319

         Hz     ppm     Int.
    

       2897.22   7.250    204
       2894.65   7.243    203
       2888.92   7.229    202
       2886.35   7.223    200
       2857.42   7.150    137
       2851.32   7.135    149
       2848.88   7.129    164
       2842.90   7.114    157
       2761.47   6.910    122
       2758.79   6.904    115
       2753.17   6.889    202
       2750.61   6.883    190
       2744.87   6.869    102
       2742.19   6.862     96
        926.76   2.319   1000
    

in CDCl3



liquid film



2-Bromo-4-fluorotoluene(1422-53-3) 13C NMR Atlas of Related Products

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