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112-25-4

乙二醇己醚(112-25-4)核磁图(1HNMR)

产品名称:乙二醇己醚

CAS:112-25-4

分子式:C8H18O2

分子量: 146.23

InChI:InChI=1S/C8H18O2/c1-2-3-4-5-7-10-8-6-9/h9H,2-8H2,1H3

InChIKey: UPGSWASWQBLSKZ-UHFFFAOYSA-N

Smiles:C(O)COCCCCCC

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    Mass

    MS-NW-4281          
    2-(hexyloxy)ethanol
    C8H18O2             (Mass of molecular ion:    146)
    

       Source Temperature: 240 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          15.0       1.3
          19.0       1.3
          27.0       9.8
          28.0       2.3
          29.0       9.8
          31.0       5.5
          39.0       4.3
          41.0      18.8
          42.0       5.9
          43.0     100.0
          44.0       3.6
          45.0      42.4
          46.0       1.0
          52.0       1.3
          55.0      12.3
          56.0      15.4
          57.0      16.0
          63.0      14.3
          69.0       4.1
          73.0       1.2
          75.0       9.2
          79.0       2.0
          83.0      16.5
          84.0      11.2
          85.0      64.6
          86.0       4.4
          99.0       1.4
         115.0       6.3
         117.0       1.7
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C8 H18 O2 0.04 ml : 0.5 ml CDCl3
    2-(hexyloxy)ethanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.72 B 3.52 C 3.48 D 2.51 E 1.59 F 1.49 to 1.16 G 0.90

         Hz     ppm     Int.
    

        339.25   3.788    177
        338.00   3.775    204
        334.56   3.736    352
        334.00   3.730    326
        332.63   3.715    303
        330.81   3.694    243
        329.81   3.683    563
        329.25   3.677    539
        320.63   3.581    568
        319.81   3.571    576
        318.81   3.560    280
        317.13   3.541    615
        315.88   3.528    412
        315.19   3.520    445
        314.38   3.511    303
        313.56   3.502    237
        311.00   3.473   1000
        304.50   3.400    469
        224.81   2.511    635
        142.44   1.591    189
        117.31   1.310    713
         85.31   0.953    270
         79.81   0.892    853
         77.63   0.867    188
         74.00   0.827    159
    

in CDCl3

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CCl4 solution

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liquid film

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4880 A,200 M,liquid

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