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139-59-3

4-氨基二苯醚(139-59-3)红外图谱(IR2)

产品名称:4-氨基二苯醚

CAS:139-59-3

分子式:C12H11NO

分子量: 185.22

InChI:InChI=1S/C12H11NO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H,13H2

InChIKey: WOYZXEVUWXQVNV-UHFFFAOYSA-N

Smiles:C1(N)=CC=C(OC2=CC=CC=C2)C=C1

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    Mass

    MS-NW-7804          
    p-phenoxyaniline
    C12H11NO            (Mass of molecular ion:    185)
    

       Source Temperature: 170 °C
       Sample Temperature: 200 °C
       Direct, 75 eV
    

          26.0       3.3
          27.0      11.1
          28.0      13.5
          29.0       1.0
          30.0       1.6
          37.0       3.3
          38.0      10.2
          39.0      35.4
          40.0       3.3
          41.0       5.7
          42.0       2.1
          49.0       1.1
          50.0      15.7
          51.0      42.3
          52.0      21.9
          53.0      32.1
          54.0      11.3
          55.0       1.3
          61.0       2.1
          62.0       6.0
          63.0      12.9
          64.0       5.6
          65.0      21.2
          66.0       4.4
          74.0       4.0
          75.0       3.0
          76.0       3.0
          77.0      26.2
          78.0       6.1
          79.0       3.1
          80.0      79.0
          81.0       5.7
          89.0       1.2
          90.0       1.0
          91.0       1.7
          92.0       1.9
         102.0       1.5
         103.0       1.6
         108.0      86.8
         109.0       7.8
         115.0       2.4
         127.0       2.1
         128.0       4.9
         129.0       6.7
         130.0       4.4
         139.0       1.4
         141.0       1.1
         154.0       1.6
         156.0      13.4
         157.0       4.3
         184.0       2.2
         185.0     100.0
         186.0      14.2
         187.0       1.3
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C12 H11 N O 0.034 g : 0.5 ml CDCl3
    p-phenoxyaniline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.269 B 7.006 C 6.927 D 6.867 E 6.665 F 3.5

         Hz     ppm     Int.
    

       2916.14   7.297     57
       2913.94   7.292    406
       2911.74   7.286    147
       2908.94   7.279     78
       2906.49   7.273    571
       2905.27   7.270    534
       2902.83   7.264     85
       2899.78   7.256    187
       2897.83   7.251    530
       2895.39   7.245     79
       2807.98   7.027    133
       2806.88   7.024    245
       2805.79   7.021    141
       2800.78   7.009    168
       2799.56   7.006    407
       2798.71   7.003    192
       2793.21   6.990    109
       2792.11   6.987    191
       2791.02   6.984    105
       2775.15   6.944     96
       2774.41   6.943    104
       2773.07   6.939    560
       2771.85   6.936    660
       2771.12   6.934    332
       2769.78   6.931    173
       2766.24   6.922    191
       2765.26   6.920    315
       2764.28   6.917    585
       2763.18   6.915    484
       2760.62   6.908     66
       2752.56   6.888     78
       2749.15   6.879    845
       2746.95   6.874    276
       2742.68   6.863    309
       2740.36   6.857   1000
       2736.94   6.849    112
       2670.78   6.683    105
       2667.48   6.675   1000
       2665.16   6.669    296
       2660.89   6.659    269
       2658.69   6.653    741
       2655.27   6.644     76
    

in CDCl3

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KBr disc

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nujol mull

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