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Back ChemicalBook Home>CAS DataBase List>89-99-6More Spectrum> 2-Fluorobenzylamine(89-99-6) MS

2-Fluorobenzylamine(89-99-6) MS

Product Name2-Fluorobenzylamine

CAS89-99-6

Molecular FormulaC7H8FN

Molecular Weight125.14

InChIInChI=1S/C7H8FN/c8-7-4-2-1-3-6(7)5-9/h1-4H,5,9H2

InChIKey LRFWYBZWRQWZIM-UHFFFAOYSA-N

SmilesC1(CN)=CC=CC=C1F


  • Mass

    MS-NW-5444          
    o-fluorobenzylamine
    C7H8FN              (Mass of molecular ion:    125)
    

       Source Temperature: 250 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       1.2
          27.0       1.8
          28.0      34.4
          29.0      13.9
          30.0      47.9
          31.0       1.5
          37.0       1.4
          38.0       1.8
          39.0       4.6
          44.0       1.0
          48.0       1.1
          49.0       1.0
          50.0       7.3
          51.0      11.2
          51.5       1.6
          52.0       2.6
          52.5       2.1
          57.0       4.7
          61.0       1.6
          62.0       3.6
          62.5       1.0
          63.0       3.4
          68.0       1.8
          69.0       2.6
          70.0       3.5
          74.0       3.0
          75.0       7.7
          76.0       2.6
          77.0      16.8
          78.0       5.7
          79.0       2.5
          81.0       1.8
          83.0       7.6
          89.0       1.2
          94.0       1.6
          95.0       5.5
          96.0      12.8
          97.0      23.8
          98.0       2.2
         102.0       3.9
         104.0      10.7
         105.0      46.0
         106.0       9.2
         107.0       5.3
         108.0       2.4
         109.0      23.3
         110.0       2.5
         121.0       1.4
         122.0       4.6
         123.0       1.4
         124.0     100.0
         125.0      35.3
         126.0       2.7
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C7 H8 F N 0.04 ml : 0.5 ml CDCl3
    o-fluorobenzylamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.44 to 6.88 B 3.883 C 1.51

         Hz     ppm     Int.
    

        664.75   7.423     39
        664.19   7.417     46
        662.00   7.392     76
        661.44   7.386     75
        659.44   7.364     38
        658.81   7.357     43
        656.88   7.335    142
        656.38   7.329    135
        654.81   7.312    153
        654.44   7.308    165
        653.75   7.300    154
        647.88   7.235    166
        647.06   7.225    158
        646.13   7.215    188
        644.13   7.193    224
        641.56   7.164    248
        639.75   7.144    362
        638.69   7.132    326
        637.06   7.114    199
        636.38   7.106    157
        635.50   7.096    227
        634.75   7.088    229
        632.75   7.066    172
        629.31   7.027     91
        627.13   7.003    178
        625.69   6.987     73
        624.31   6.971    157
        620.44   6.928     46
        619.13   6.914     51
        617.94   6.900     47
        617.19   6.892     48
        347.75   3.883    828
        135.63   1.515   1000
    

in CDCl3



liquid film





2-Fluorobenzylamine(89-99-6) MS Atlas of Related Products

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