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返回ChemicalBook首页>CAS数据库列表>14438-32-5更多图谱> 3,5-二甲基-2-氨基苯甲酸(14438-32-5)核磁图(13CNMR)

14438-32-5

3,5-二甲基-2-氨基苯甲酸(14438-32-5)核磁图(13CNMR)

分子式:C9H11NO2

分子量: 165.19

InChI:InChI=1S/C9H11NO2/c1-5-3-6(2)8(10)7(4-5)9(11)12/h3-4H,10H2,1-2H3,(H,11,12)

InChIKey: GIMYRAQQQBFFFJ-UHFFFAOYSA-N

Smiles:C(O)(=O)C1=CC(C)=CC(C)=C1N

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    Mass

    MS-KW-0177          
    3,5-dimethylanthranilic acid
    C9H11NO2            (Mass of molecular ion:    165)
    

       Source Temperature: 170 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          18.0       1.8
          27.0       1.7
          28.0       3.7
          39.0       4.8
          41.0       2.4
          42.0       1.2
          46.5       1.9
          50.0       1.3
          51.0       4.1
          52.0       4.1
          53.0       2.9
          54.0       1.2
          58.5       9.5
          59.0       2.2
          59.5       2.5
          63.0       2.3
          64.0       1.0
          65.0       7.8
          66.0       1.6
          73.5       8.8
          74.0       2.3
          76.0       1.2
          77.0       6.5
          78.0       2.8
          79.0       1.2
          82.5       4.0
          89.0       2.3
          90.0       2.0
          91.0      14.1
          92.0       4.0
          93.0       2.0
         102.0       1.3
         103.0       1.6
         104.0      15.6
         105.0       1.8
         106.0       1.0
         116.0       3.1
         117.0       4.7
         118.0      43.4
         119.0      91.7
         120.0      13.6
         121.0       1.7
         132.0       1.4
         146.0      12.7
         147.0      57.2
         148.0       7.4
         164.0       1.9
         165.0     100.0
         166.0      10.5
    

400 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C9 H11 N O2 0.038 g : 0.5 ml DMSO-d6
    3,5-dimethylanthranilic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.449 B 7.002 C *1 2.139 D *1 2.087

         Hz     ppm     Int.
    

       2976.99   7.449    196
       2799.22   7.005    192
       2798.61   7.003    192
       2798.00   7.002    192
        855.10   2.140   1000
        847.32   2.121     30
        846.10   2.118     28
        842.13   2.108     33
        834.35   2.088    948
    

in DMSO-d6

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KBr disk

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Nujol

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