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Back ChemicalBook Home>CAS DataBase List>367-12-4More Spectrum> 2-Fluorophenol(367-12-4) 13C NMR

2-Fluorophenol(367-12-4) 13C NMR

Product Name2-Fluorophenol

CAS367-12-4

Molecular FormulaC6H5FO

Molecular Weight112.1

InChIInChI=1S/C6H5FO/c7-5-3-1-2-4-6(5)8/h1-4,8H

InChIKey HFHFGHLXUCOHLN-UHFFFAOYSA-N

SmilesC1(O)=CC=CC=C1F


  • Mass

    MS-NW-1127          
    o-fluorophenol
    C6H5FO              (Mass of molecular ion:    112)
    

       Source Temperature: 240 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          18.0       1.0
          27.0       1.0
          28.0       2.5
          29.0       1.2
          31.0       3.8
          37.0       2.2
          38.0       4.5
          39.0       4.6
          45.0       1.0
          50.0       2.5
          51.0       1.6
          53.0       2.8
          55.0       1.1
          56.0       5.1
          57.0      11.5
          58.0       1.6
          61.0       1.6
          62.0       2.5
          63.0      18.4
          64.0      53.7
          65.0       3.6
          68.0       1.0
          73.0       2.1
          75.0       1.0
          81.0       2.2
          82.0       1.2
          83.0      12.0
          84.0       2.6
          92.0      19.8
          93.0       1.5
         111.0       1.2
         112.0     100.0
         113.0       6.7
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C6 H5 F O 0.05 ml : 0.5 ml CDCl3
    o-fluorophenol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.02 B 7.00 C 6.97 D 6.810 E 5.88

         Hz     ppm     Int.
    

       2822.51   7.063     34
       2818.36   7.053    275
       2817.99   7.052    275
       2816.89   7.049    324
       2810.18   7.032    361
       2808.72   7.028    428
       2807.50   7.025    337
       2806.52   7.023    542
       2805.66   7.021    384
       2804.81   7.019    299
       2798.71   7.003    677
       2798.34   7.002    635
       2797.49   7.000    541
       2796.63   6.998    661
       2793.95   6.991    389
       2792.48   6.988   1000
       2791.50   6.985    931
       2788.94   6.979    562
       2788.45   6.978    525
       2786.87   6.974    797
       2785.40   6.970    749
       2778.81   6.954    236
       2777.34   6.950    228
       2732.42   6.838    278
       2730.35   6.832    284
       2727.54   6.825    289
       2725.22   6.820    251
       2724.12   6.817    435
       2723.27   6.815    327
       2722.17   6.812    373
       2719.48   6.805    259
       2718.38   6.802    269
       2717.04   6.799    247
       2716.19   6.797    264
       2715.09   6.794    238
       2713.38   6.790    208
       2710.21   6.782    191
       2350.34   5.881    594
       2346.68   5.872    597
    

in CDCl3



liquid film





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