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吲哚-4-羧酸

产品名称 吲哚-4-羧酸

CAS号2124-55-2

分子式C9H7NO2

分子量161.16

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  • Mass

    MS-IW-1332          
    4-indolecarboxylic acid
    C9H7NO2             (Mass of molecular ion:    161)
    

       Source Temperature: 170 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          58.0       1.1
          62.0       1.7
          63.0       2.7
          66.5       1.6
          77.0       1.4
          87.0       1.0
          88.0       1.3
          89.0       7.6
          90.0       1.8
         104.0       1.4
         105.0       1.2
         114.0       1.0
         115.0       2.2
         116.0      26.1
         117.0       3.0
         132.0       1.2
         133.0       1.6
         144.0      51.8
         145.0       5.4
         160.0       1.4
         161.0     100.0
         162.0      10.3
    

400 MHz in DMSO-d6


  • 1H NMR 399.65 MHz
    C9 H7 N O2 0.038 g : 0.5 ml DMSO-d6
    4-indolecarboxylic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 12.6 B 11.42 C 7.767 D 7.692 E 7.527 F 7.207 G 7.015

         Hz     ppm     Int.
    

       4565.61  11.425    285
       3108.89   7.780    828
       3107.79   7.777    856
       3105.59   7.771     51
       3104.49   7.769     54
       3101.38   7.761    958
       3100.46   7.758    925
       3079.21   7.705    532
       3078.30   7.703    846
       3077.38   7.701    487
       3071.15   7.685    614
       3070.24   7.683    932
       3069.32   7.681    518
       3011.07   7.535    656
       3008.33   7.528    992
       3005.40   7.521    664
       3001.55   7.511     33
       2887.99   7.227    711
       2884.51   7.218     38
       2883.96   7.217     37
       2880.29   7.208   1000
       2876.63   7.198     39
       2872.60   7.188    633
       2806.48   7.023    473
       2805.56   7.021    524
       2804.46   7.018    612
       2803.55   7.016    851
       2802.63   7.013    568
       2801.35   7.010    513
       2800.62   7.008    428
    

in DMSO-d6



KBr disc



nujol mull