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4-tert-Butylbenzoic acid

Product Name 4-tert-Butylbenzoic acid

CAS98-73-7

MFC11H14O2

MW178.23

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  • Mass

    MS-NW-1639          
    p-tert-butylbenzoic acid
    C11H14O2            (Mass of molecular ion:    178)
    

       Source Temperature: 240 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          27.0       2.6
          29.0       2.7
          39.0       7.1
          41.0      19.1
          45.0       1.8
          50.0       2.5
          51.0       4.8
          52.0       1.0
          53.0       1.2
          57.0       1.2
          58.0       1.2
          63.0       2.1
          65.0       3.2
          72.0       1.1
          74.0       1.0
          75.0       1.5
          76.0       1.3
          77.0       7.7
          78.0       1.6
          79.0       6.8
          89.0       1.2
          90.0       1.1
          91.0      23.6
          92.0       1.8
         102.0       1.1
         103.0       2.9
         105.0       2.4
         107.0       3.6
         115.0       4.0
         116.0       1.1
         117.0       3.3
         118.0       2.0
         119.0       1.7
         123.0       1.3
         135.0      22.2
         136.0       2.2
         145.0       1.8
         163.0     100.0
         164.0      11.3
         165.0       1.0
         178.0      21.0
         179.0       2.6
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C11 H14 O2 0.046 g : 0.5 ml CDCl3
    p-tert-butylbenzoic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 10. B 8.047 C 7.497 D 1.355

         Hz     ppm     Int.
    

        725.72   8.104     59
        717.35   8.010     68
        716.92   8.005     71
        675.05   7.538     80
        666.33   7.441     52
        121.34   1.355   1000
        119.37   1.333     53
    

in CDCl3



CCl4 solution



KBr disc



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