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5459-58-5

氰乙酸正丁酯(5459-58-5)核磁图(1HNMR)

产品名称:氰乙酸正丁酯

CAS:5459-58-5

分子式:C7H11NO2

分子量: 141.17

InChI:InChI=1S/C7H11NO2/c1-2-3-6-10-7(9)4-5-8/h2-4,6H2,1H3

InChIKey: DJACTCNGCHPGOI-UHFFFAOYSA-N

Smiles:C(OCCCC)(=O)CC#N

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    Mass

    MS-NW-0934          
    butyl cyanoacetate
    C7H11NO2            (Mass of molecular ion:    141)
    

       Source Temperature: 280 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       1.7
          18.0       2.7
          26.0       2.0
          27.0      17.1
          28.0       9.5
          29.0      26.9
          31.0       5.7
          38.0       1.4
          39.0      11.1
          40.0      15.6
          41.0      64.0
          42.0       5.3
          43.0      16.5
          44.0       4.1
          45.0       1.9
          53.0       1.0
          54.0       1.8
          55.0      13.2
          56.0     100.0
          57.0      25.9
          58.0       1.1
          59.0       1.3
          60.0       1.0
          67.0       2.1
          68.0      61.3
          69.0       2.5
          71.0       2.7
          73.0       1.0
          82.0       3.0
          86.0      10.3
          99.0       1.4
         112.0       4.0
    

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in CDCl3

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CCl4 solution

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liquid film

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