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网站主页CAS数据库列表 626-01-7更多图谱3-碘苯胺(626-01-7)红外图谱(IR1)

3-碘苯胺

产品名称 3-碘苯胺

CAS号626-01-7

分子式C6H6IN

分子量219.02

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  • Mass

    MS-NW-0690          
    m-iodoaniline
    C6H6IN              (Mass of molecular ion:    219)
    

       Source Temperature: 200 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          18.0       1.6
          28.0       3.2
          37.0       1.9
          38.0       4.5
          39.0      11.2
          40.0       1.2
          41.0       2.7
          50.0       2.0
          51.0       1.2
          52.0       4.1
          61.0       1.6
          62.0       3.1
          63.0       6.8
          64.0       6.0
          65.0      38.9
          66.0       4.5
          74.0       1.8
          90.0       1.2
          91.0       7.3
          92.0      65.6
          93.0       5.0
         109.5       7.2
         127.0       3.6
         219.0     100.0
         220.0       7.0
    

400 MHz in CDCl3

90 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C6 H6 I N 0.05 ml : 0.5 ml CDCl3
    m-iodoaniline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.029 B 6.955 C 6.808 D 6.540 E 3.56 90MHZ:HSP-04-515

         Hz     ppm     Int.
    

       2814.70   7.043    419
       2813.72   7.041    475
       2813.11   7.039    459
       2812.13   7.037    399
       2809.94   7.032     80
       2806.88   7.024    476
       2806.03   7.022    551
       2805.30   7.020    543
       2804.44   7.018    460
       2799.19   7.005     32
       2792.36   6.988     30
       2791.99   6.987     30
       2791.63   6.986     30
       2790.04   6.982     31
       2781.74   6.961    705
       2779.91   6.956    827
       2777.83   6.951    646
       2733.28   6.840     34
       2728.88   6.829    618
       2725.22   6.820     66
       2724.00   6.816     70
       2720.83   6.809   1000
       2716.19   6.797     56
       2713.01   6.789    595
       2709.47   6.780     35
       2619.26   6.554    478
       2618.29   6.552    456
       2616.94   6.549    474
       2616.09   6.546    420
       2611.21   6.534    415
       2610.23   6.532    399
       2608.89   6.528    415
       2607.91   6.526    366
       1423.22   3.562    182
    


  • 1H NMR 89.56 MHz
    C6 H6 I N 0.045 g : 0.5 ml CDCl3
    m-iodoaniline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.04 B 7.01 C 6.84 D 6.595 E 3.55 J(A,B)=1.4HZ J(A,C)=7.6HZ J(A,D)=1.4HZ J(B,C)=0.8HZ J(B,D)=2.3HZ J(C,D)=7.9HZ 400MHZ:HSP-44-804

         Hz     ppm     Int.
    

        637.69   7.121     96
        636.19   7.104    193
        634.81   7.089    161
        630.13   7.036    290
        629.13   7.025   1000
        627.56   7.008    668
        626.38   6.994    258
        620.00   6.923    225
        619.00   6.912    142
        613.44   6.850    100
        612.13   6.835    386
        611.38   6.827    280
        604.94   6.755    195
        604.13   6.746    199
        595.06   6.645    272
        593.69   6.629    289
        592.81   6.620    263
        591.44   6.604    238
        587.19   6.557    151
        585.63   6.539    160
        585.19   6.535    138
        583.63   6.517    124
        318.31   3.555    669
    

in CDCl3



CCl4 solution



liquid film