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网站主页CAS数据库列表 106-73-0更多图谱庚酸甲酯(106-73-0)核磁图(1HNMR)

庚酸甲酯

产品名称 庚酸甲酯

CAS号106-73-0

分子式C8H16O2

分子量144.21

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  • Mass

    MS-NW-4846          
    methyl heptanoate
    C8H16O2             (Mass of molecular ion:    144)
    

       Source Temperature: 260 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       7.6
          18.0       1.0
          27.0       8.9
          28.0       2.7
          29.0      10.2
          31.0       1.6
          39.0       5.4
          40.0       1.0
          41.0      16.0
          42.0       4.0
          43.0      26.1
          44.0       1.4
          45.0       1.6
          53.0       1.0
          55.0       9.3
          56.0       3.3
          57.0       3.8
          59.0      10.2
          68.0       1.1
          69.0       3.9
          73.0       2.6
          74.0     100.0
          75.0       6.0
          83.0       1.7
          84.0       4.2
          85.0       3.6
          87.0      33.7
          88.0       4.2
         101.0      11.3
         113.0      12.2
         115.0       2.6
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C8 H16 O2 0.04 ml : 0.5 ml CDCl3
    methyl heptanoate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 0.89 B 1.14 to 1.46 C 1.62 D 2.30 E 3.662

         Hz     ppm     Int.
    

        328.06   3.664   1000
        214.50   2.396     48
        214.19   2.392     47
        213.38   2.383     47
        206.81   2.310    122
        199.69   2.230     97
        199.38   2.227     92
        156.38   1.747     46
        146.75   1.639     36
        145.69   1.627     41
        145.13   1.621     45
        144.75   1.617     44
        143.81   1.606     40
        143.38   1.601     38
        143.00   1.597     37
        138.69   1.549     37
        138.38   1.546     37
        127.44   1.423     35
        127.06   1.419     38
        126.75   1.416     39
        125.44   1.401     48
        123.69   1.382     64
        123.38   1.378     62
        118.13   1.320    163
        116.00   1.296    220
        115.31   1.288    223
        108.19   1.209     39
         86.63   0.968     43
         85.63   0.957     58
         84.63   0.945     68
         81.69   0.913     58
         79.25   0.885    197
         76.50   0.855     47
         73.25   0.818     42
         72.88   0.814     42
         72.13   0.806     37
    

in CDCl3



CCl4 solution



liquid film



4880 A,200 M,liquid