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己酸异戊酯

产品名称 己酸异戊酯

CAS号2198-61-0

分子式C11H22O2

分子量186.29

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  • Mass

    MS-NW-8472          
    isopentyl hexanoate
    C11H22O2            (Mass of molecular ion:    186)
    

       Source Temperature: 260 °C
       Sample Temperature: 140 °C
       Reservoir, 75 eV
    

          27.0       8.3
          28.0       3.4
          29.0      12.8
          39.0       4.9
          41.0      18.9
          42.0      13.9
          43.0      73.0
          44.0       2.7
          45.0       1.9
          53.0       1.2
          54.0       1.0
          55.0      31.7
          56.0       3.5
          57.0       3.0
          60.0       5.3
          61.0       1.6
          69.0       6.0
          70.0     100.0
          71.0      45.9
          72.0       2.6
          73.0       4.5
          85.0       1.6
          87.0       3.3
          89.0       1.2
          99.0      43.8
         100.0       3.2
         113.0       2.2
         115.0       1.4
         116.0       1.3
         117.0      10.1
         143.0       2.0
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C11 H22 O2 0.04 ml : 0.5 ml CDCl3
    isopentyl hexanoate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.099 B 2.28 C 1.62 D 1.55 E 1.31 F 0.924 G 0.90

         Hz     ppm     Int.
    

        373.75   4.174    162
        367.00   4.098    273
        360.44   4.025    155
        212.69   2.375     59
        211.56   2.363     60
        204.94   2.289    160
        197.81   2.209    113
        197.25   2.203    127
        153.38   1.713     75
        152.50   1.703     83
        151.81   1.696     75
        149.13   1.666     45
        146.56   1.637     92
        144.88   1.618    137
        143.44   1.602    111
        141.94   1.585     70
        140.75   1.572     82
        139.94   1.563     84
        138.31   1.545    200
        135.00   1.508     49
        134.69   1.504     49
        132.75   1.483     87
        131.69   1.471    147
        127.50   1.424     44
        125.75   1.405     77
        124.38   1.389     88
        122.69   1.370    170
        119.94   1.340    133
        118.56   1.324    134
        117.25   1.310    119
        117.13   1.308    119
        115.63   1.292    165
        112.88   1.261     94
        112.56   1.257     92
        108.69   1.214     68
         87.56   0.978    108
         85.50   0.955   1000
         79.63   0.890    839
         75.50   0.844     56
         74.19   0.829     85
         72.81   0.813     64
    

in CDCl3



CCl4 solution



liquid film



4880 A,200 M,liquid