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网站主页CAS数据库列表 91-40-7更多图谱N-苯基邻氨基苯甲酸(91-40-7)质谱(MS)

N-苯基邻氨基苯甲酸

产品名称 N-苯基邻氨基苯甲酸

CAS号91-40-7

分子式C13H11NO2

分子量213.23

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  • Mass

    MS-NW-0342          
    o-anilinobenzoic acid
    C13H11NO2           (Mass of molecular ion:    213)
    

       Source Temperature: 180 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          18.0       1.5
          27.0       1.0
          28.0       1.4
          38.0       1.1
          39.0       5.0
          50.0       2.7
          51.0       8.9
          52.0       1.5
          63.0       3.3
          64.0       3.4
          65.0       3.8
          66.0       1.1
          69.5       1.5
          70.0       1.3
          70.5       3.0
          74.0       1.0
          75.0       1.3
          76.0       1.6
          77.0      13.7
          78.0       1.4
          82.5       1.7
          83.5      11.3
          84.0       1.7
          84.5       1.2
          89.0       1.0
          91.0       1.0
          92.0       9.0
          97.5       1.2
         115.0       1.8
         139.0       6.0
         140.0       4.7
         141.0       1.2
         165.0       1.1
         166.0      13.0
         167.0      29.4
         168.0       7.0
         169.0       2.6
         194.0       1.8
         195.0     100.0
         196.0      15.7
         197.0       1.4
         213.0      63.7
         214.0       9.4
    

400 MHz in CDCl3

90 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C13 H11 N O2 0.039 g : 0.5 ml DMSO-d6
    o-anilinobenzoic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 13. B 9.68 C 7.937 D 7.394 E 7.367 F 7.26 G 7.25 J 7.084 K 6.792 ASSIGNED BY C-H COSY

         Hz     ppm     Int.
    

       3869.60   9.683     51
       3177.05   7.950    410
       3175.56   7.946    421
       3169.15   7.930    443
       3167.44   7.926    428
       2963.58   7.416    225
       2961.88   7.412    230
       2956.53   7.398    291
       2955.04   7.395    481
       2953.33   7.390    438
       2952.69   7.389    547
       2950.55   7.383    213
       2947.99   7.377    403
       2946.28   7.373    587
       2945.21   7.370    763
       2944.14   7.367    888
       2942.22   7.362    173
       2938.80   7.354    257
       2936.87   7.349    745
       2934.74   7.344    126
       2906.53   7.273    195
       2904.82   7.269    845
       2903.54   7.266   1000
       2900.76   7.259    582
       2899.69   7.256    602
       2898.20   7.252    305
       2897.13   7.250    433
       2896.27   7.248    739
       2895.21   7.245    602
       2892.00   7.237    427
       2891.15   7.235    406
       2839.22   7.105    183
       2838.15   7.102    313
       2836.87   7.099    178
       2831.74   7.086    264
       2830.89   7.084    517
       2824.69   7.068    154
       2823.41   7.065    259
       2822.34   7.063    139
       2722.55   6.813    285
       2721.48   6.810    289
       2715.50   6.795    336
       2714.43   6.793    493
       2713.57   6.790    333
       2707.59   6.775    271
       2706.31   6.772    259
    


  • 1H NMR 89.56 MHz
    C13 H11 N O2 0.036 g : 0.5 ml CDCl3
    o-anilinobenzoic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 11. B *1 9.3 C 8.05 D 7.51 to 6.99 E 6.750

         Hz     ppm     Int.
    

        832.62   9.297     52
        726.15   8.108    147
        725.72   8.104    156
        724.52   8.090    177
        724.10   8.086    167
        718.20   8.020    160
        717.60   8.013    172
        716.66   8.003    188
        715.98   7.995    171
        669.49   7.476     58
        668.21   7.462    101
        667.27   7.451     85
        666.33   7.441     67
        665.56   7.432     85
        664.45   7.420     42
        663.26   7.406     77
        662.49   7.398    113
        660.52   7.376    317
        659.33   7.362    321
        658.73   7.356    261
        657.02   7.337    235
        654.46   7.308    742
        653.77   7.300    734
        653.09   7.293    714
        652.23   7.283   1000
        650.61   7.265    406
        650.01   7.258    369
        649.50   7.253    358
        648.05   7.236    564
        645.23   7.205    282
        643.60   7.187    176
        642.32   7.172    117
        641.38   7.162    127
        640.87   7.156    131
        639.76   7.144    165
        638.13   7.126     91
        636.77   7.110    151
        633.26   7.071     70
        630.44   7.040     70
        628.39   7.017     37
        612.07   6.835    146
        610.36   6.816    134
        605.66   6.763    129
        603.96   6.744    220
        602.16   6.724    127
        597.72   6.674    111
        595.84   6.653    101
    

in DMSO-d6



CCl4 solution



KBr disc



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