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111-34-2

乙烯基正丁醚(111-34-2)红外图谱(IR2)

产品名称:乙烯基正丁醚

CAS:111-34-2

分子式:C6H12O

分子量: 100.16

InChI:InChI=1S/C6H12O/c1-3-5-6-7-4-2/h4H,2-3,5-6H2,1H3

InChIKey: UZKWTJUDCOPSNM-UHFFFAOYSA-N

Smiles:C(OC=C)CCC

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    Mass

    MS-NW-1216          
    butyl vinyl ether
    C6H12O              (Mass of molecular ion:    100)
    

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

          14.0       1.3
          15.0       5.9
          18.0       1.1
          26.0       3.5
          27.0      31.4
          28.0       7.9
          29.0     100.0
          30.0       2.1
          31.0      15.6
          39.0      13.7
          40.0       2.3
          41.0      99.1
          42.0       4.8
          43.0      11.5
          44.0      33.5
          45.0      11.7
          53.0       1.9
          55.0      11.4
          56.0      83.0
          57.0      62.6
          58.0       2.9
          59.0       5.4
          85.0      27.6
          86.0       1.6
         100.0      14.5
         101.0       1.1
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C6 H12 O 0.04 ml : 0.5 ml CDCl3
    butyl vinyl ether
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.459 B 4.169 C 3.964 D 3.675 E 1.61 F 1.39 G 0.94

         Hz     ppm     Int.
    

        589.63   6.584    209
        582.81   6.508    223
        575.31   6.424    236
        568.50   6.348    253
        381.13   4.256    305
        379.31   4.236    351
        366.88   4.097    249
        365.00   4.076    330
        359.19   4.011    397
        357.31   3.990    361
        352.31   3.934    398
        350.50   3.914    313
        335.94   3.752    260
        329.69   3.682    642
        326.13   3.642     33
        323.38   3.611    357
        160.69   1.795     44
        155.81   1.740     63
        154.25   1.723    110
        152.13   1.699     92
        150.63   1.682     65
        147.63   1.649    204
        146.69   1.638    155
        145.75   1.628    169
        141.75   1.583    261
        140.19   1.566    199
        139.25   1.555    189
        136.06   1.520    261
        134.75   1.505    174
        131.81   1.472    135
        130.06   1.453    193
        128.38   1.434    197
        126.06   1.408     72
        124.56   1.391    169
        121.50   1.357    176
        119.56   1.335     93
        118.19   1.320     89
        115.00   1.285    151
        114.13   1.275    101
        109.31   1.221     51
        108.56   1.213     69
        107.25   1.198     75
         91.63   1.024    241
         90.75   1.014    443
         89.88   1.004    404
         86.81   0.970     74
         86.06   0.961     66
         84.06   0.939   1000
         82.63   0.923    343
         77.94   0.871    168
         76.56   0.855    208
         74.75   0.835    112
    

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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