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88-44-8

4-Aminotoluene-3-sulfonic acid

Product Name 4-Aminotoluene-3-sulfonic acid

CAS88-44-8

MFC7H9NO3S

MW187.22

More

  • 88-44-8_ms
    Mass

    MS-NW-3293          
    2-amino-5-methylbenzenesulfonic acid
    C7H9NO3S            (Mass of molecular ion:    187)
    

       Source Temperature: 230 °C
       Sample Temperature: 220 °C
       Direct, 75 eV
    

          17.0       3.3
          18.0      11.8
          26.0       3.4
          27.0       8.7
          28.0       9.0
          30.0       1.8
          32.0       1.8
          34.0       1.1
          36.0       1.2
          37.0       2.6
          38.0       4.7
          39.0      13.9
          40.0       2.2
          41.0       4.4
          42.0       2.5
          45.0       1.0
          48.0       9.7
          49.0       1.5
          50.0      10.8
          51.0      21.3
          52.0      19.0
          53.0       9.2
          54.0       5.0
          55.0       1.0
          61.0       1.7
          62.0       3.5
          63.0       7.2
          64.0      10.4
          65.0       7.6
          66.0       5.1
          67.0       2.9
          74.0       2.5
          75.0       3.1
          76.0       7.9
          77.0      38.1
          78.0      34.9
          79.0      16.5
          80.0       4.1
          81.0       2.0
          89.0       2.3
          90.0       1.5
          91.0       3.7
          92.0       2.1
          93.0       4.0
          94.0       6.3
         102.0       1.3
         103.0       6.4
         104.0     100.0
         105.0      53.0
         106.0      40.6
         107.0      16.9
         108.0       1.6
         120.0       2.1
         122.0       4.4
         123.0       1.0
         152.0       2.4
         168.0       3.2
         169.0      10.0
         170.0       1.2
         186.0       3.6
         187.0      62.5
         188.0       5.8
         189.0       3.5
    

400 MHz in DMSO-d6

90 MHz in DMSO-d6

  • 88-44-8_1hnmr_2

    1H NMR 399.65 MHz
    C7 H9 N O3 S 0.040 g : 0.5 ml DMSO-d6
    2-amino-5-methylbenzenesulfonic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.68 B 7.601 C 7.297 D 7.243 E 2.330

         Hz     ppm     Int.
    

       3870.09   9.684     72
       3038.79   7.604    233
       3037.41   7.601    237
       2922.36   7.313     86
       2920.99   7.309     86
       2914.28   7.293    160
       2912.90   7.289    158
       2897.80   7.251    299
       2889.71   7.231    157
        931.40   2.331   1000
    

  • 88-44-8_1hnmr

    1H NMR 89.56 MHz
    C7 H9 N O3 S 0.041 g : 0.5 ml DMSO-d6
    2-amino-5-methylbenzenesulfonic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.9 B 7.60 C 7.28 D 7.25 E 2.330

         Hz     ppm     Int.
    

        702.56   7.845    180
        686.00   7.660     29
        685.25   7.652     28
        684.50   7.643     28
        681.06   7.605    210
        680.19   7.595    247
        679.56   7.588    232
        660.06   7.371     30
        651.50   7.275    265
        650.06   7.259    572
        642.00   7.169     36
        641.25   7.161     28
        208.56   2.329   1000
    

in DMSO-d6

  • 88-44-8_13cnmr

KBr disc

  • 88-44-8_ir1_2

nujol mull

  • 88-44-8_ir2