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4606-07-9

环丙基甲酸乙酯(4606-07-9)Raman光谱

产品名称:环丙基甲酸乙酯

CAS:4606-07-9

分子式:C6H10O2

分子量: 114.14

InChI:InChI=1S/C6H10O2/c1-2-8-6(7)5-3-4-5/h5H,2-4H2,1H3

InChIKey: LDDOSDVZPSGLFZ-UHFFFAOYSA-N

Smiles:C1(C(OCC)=O)CC1

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    Mass

    MS-NW-6445          
    ethyl cyclopropanecarboxylate
    C6H10O2             (Mass of molecular ion:    114)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          15.0       2.0
          26.0       2.0
          27.0       9.3
          28.0       1.1
          29.0      24.0
          31.0       1.3
          38.0       1.7
          39.0      17.1
          40.0       3.5
          41.0      33.9
          42.0       7.4
          43.0       2.9
          45.0       6.2
          55.0       3.7
          57.0       1.0
          58.0       5.7
          59.0       1.0
          68.0       5.0
          69.0     100.0
          70.0       5.2
          71.0       2.7
          73.0       2.8
          83.0       1.2
          85.0       6.6
          86.0      23.2
          87.0      12.3
          99.0       1.6
         114.0       3.3
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H10 O2 0.05 ml : 0.5 ml CDCl3
    ethyl cyclopropanecarboxylate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.130 B 1.596 C 1.263 D 0.958 E 0.845

         Hz     ppm     Int.
    

       1661.25   4.157    232
       1654.17   4.140    592
       1646.97   4.122    618
       1639.89   4.104    244
        650.39   1.628     58
        645.75   1.616    117
        642.46   1.608    121
        641.11   1.605     81
        637.70   1.596    230
        634.28   1.588     83
        633.18   1.585    132
        629.64   1.576    131
        625.00   1.564     70
        511.96   1.282    634
        509.40   1.275     38
        504.76   1.264   1000
        497.68   1.246    643
        399.05   0.999     91
        394.29   0.987    292
        391.48   0.980    351
        390.38   0.977    230
        389.65   0.975    270
        387.94   0.971    192
        386.84   0.968    334
        383.42   0.960    123
        382.81   0.958    106
        346.19   0.867    120
        345.58   0.865    110
        342.41   0.857    341
        339.48   0.850    243
        338.38   0.847    214
        334.35   0.837    341
        331.30   0.829    244
        327.03   0.819     93
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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