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网站主页CAS数据库列表 527-72-0更多图谱噻吩-2-甲酸(527-72-0)质谱(MS)

噻吩-2-甲酸

产品名称 噻吩-2-甲酸

CAS号527-72-0

分子式C5H4O2S

分子量128.15

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  • Mass

    MS-NW-1396          
    2-thiophenecarboxylic acid
    C5H4O2S             (Mass of molecular ion:    128)
    

       Source Temperature: 260 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          18.0       1.5
          26.0       1.2
          28.0       1.5
          37.0       3.9
          38.0       6.2
          39.0      38.7
          40.0       1.6
          41.0       1.0
          44.0       2.4
          45.0      15.5
          49.0       1.6
          50.0       4.2
          51.0       1.1
          53.0       1.8
          57.0       9.5
          58.0       6.1
          69.0       1.7
          81.0       3.4
          82.0       3.9
          83.0      10.2
          84.0       1.7
         100.0       2.0
         111.0     100.0
         112.0       6.2
         113.0       4.8
         128.0      86.3
         129.0       5.5
         130.0       4.4
    

parameter in acetone-d6


  • 1H NMR 300 MHz
    C5 H4 O2 S in acetone-d6
    2-thiophenecarboxylic acid
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 7.80 D(B) 7.15 D(C) 7.78 J(A,B) 3.67 J(A,C) 1.16 J(B,C) 5.03 D(D) 9.56 FRINGUELLI,F. ET AL. ACTA CHEM.SCAND. B 28, 175 (1974)

         Hz     ppm     Int.
    

       2868.01   9.560   1000
       2342.49   7.808    230
       2341.36   7.805    326
       2338.82   7.796    264
       2337.62   7.792    425
       2337.14   7.790    419
       2335.92   7.786    243
       2332.05   7.773    329
       2330.92   7.770    244
       2149.29   7.164    266
       2145.62   7.152    274
       2144.28   7.148    270
       2140.62   7.135    243
    

KBr disc



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