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80869-94-9

ACETIC ACID 2-ACETOXY-4-TERT-BUTYLPHENYL ESTER

Product Name ACETIC ACID 2-ACETOXY-4-TERT-BUTYLPHENYL ESTER

CAS80869-94-9

MFC14H18O4

MW250.29032

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  • 80869-94-9_ms_1
    Mass

    MS-IW-3531          
    4-tert-butyl-o-phenylene diacetate
    C14H18O4            (Mass of molecular ion:    250)
    

       Source Temperature: 130 °C
       Sample Temperature: 100 °C
       Direct, 75 eV
    

          15.0       1.0
          39.0       1.4
          41.0       3.1
          43.0      18.0
          51.0       1.2
          53.0       1.0
          55.0       1.5
          65.0       1.3
          77.0       3.1
          79.0       2.4
          91.0       1.9
          93.0       1.8
         105.0       1.9
         107.0       2.5
         111.0       1.3
         119.0       1.2
         122.0       1.3
         123.0       5.0
         133.0       1.0
         135.0       1.7
         137.0       1.1
         150.0       3.8
         151.0      92.3
         152.0       9.2
         165.0       2.9
         166.0     100.0
         167.0      11.0
         193.0       2.7
         207.0       1.1
         208.0      16.9
         209.0       2.3
         250.0       9.8
         251.0       1.5
    

400 MHz in CDCl3

  • 80869-94-9_1hnmr_0

    1H NMR 399.65 MHz
    C14 H18 O4 0.048 g : 0.5 ml CDCl3
    4-tert-butyl-o-phenylene diacetate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.254 B 7.154 C 7.099 D *1 2.281 E *1 2.267 F 1.303

         Hz     ppm     Int.
    

       2905.03   7.269     40
       2902.71   7.264     45
       2896.61   7.248     52
       2894.29   7.243     59
       2860.35   7.158     86
       2858.28   7.152     77
       2841.06   7.109     92
       2832.52   7.088     72
        911.62   2.282    548
        906.01   2.268    505
        903.93   2.262     47
        520.87   1.304   1000
    

in CDCl3

  • 80869-94-9_13cnmr_0

KBr disc

  • 80869-94-9_ir1_2

nujol mull

  • 80869-94-9_ir2_1

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