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BENZOIC ACID 2-ISOPROPOXYETHYL ESTER

Product Name BENZOIC ACID 2-ISOPROPOXYETHYL ESTER

CAS95241-36-4

MFC12H16O3

MW208.25


  • Mass

    MS-IW-3555          
    2-isopropoxyethyl benzoate
    C12H16O3            (Mass of molecular ion:    208)
    

       Source Temperature: 220 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          15.0       1.1
          27.0       4.1
          28.0       1.4
          29.0       1.1
          39.0       2.3
          41.0       5.1
          42.0       2.0
          43.0      34.3
          44.0      21.0
          45.0       7.4
          50.0       3.6
          51.0      13.0
          55.0       1.0
          58.0      21.6
          59.0       2.2
          73.0      12.0
          74.0       1.2
          75.0       1.2
          76.0       2.8
          77.0      47.5
          78.0       3.8
          79.0       2.5
          86.0      48.9
          87.0       2.9
          91.0       5.5
          92.0       7.7
         103.0       1.1
         105.0     100.0
         106.0       9.5
         118.0       1.1
         120.0       1.1
         122.0       9.2
         123.0      12.6
         124.0       1.0
         135.0       7.7
         136.0       3.6
         149.0      33.3
         150.0       6.8
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C12 H16 O3 0.05 ml : 0.5 ml CDCl3
    2-isopropoxyethyl benzoate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.061 B 7.528 C 7.415 D 4.441 E 3.746 F 3.652 G 1.182

         Hz     ppm     Int.
    

       3226.07   8.073    152
       3225.34   8.071    190
       3220.21   8.058     59
       3218.26   8.053    219
       3216.92   8.050    180
       3017.33   7.550     45
       3011.96   7.537     36
       3009.89   7.532    109
       3008.06   7.527     41
       3003.91   7.517     47
       3002.56   7.513     80
       3001.22   7.510     45
       2971.44   7.436    143
       2969.97   7.432     65
       2963.62   7.416    220
       2957.76   7.401     45
       2956.18   7.397    108
       1779.91   4.454    186
       1775.02   4.442    206
       1769.90   4.429    192
       1501.95   3.759    184
       1497.92   3.749    110
       1496.95   3.746    194
       1491.94   3.734    173
       1472.17   3.684     34
       1466.06   3.669     87
       1459.96   3.654    117
       1453.86   3.638     89
       1447.75   3.623     37
        475.34   1.190   1000
        471.56   1.180     80
        469.24   1.175    971
    

in CDCl3



liquid film