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网站主页CAS数据库列表 107-12-0更多图谱丙腈(107-12-0)ESR图谱

丙腈

产品名称 丙腈

CAS号107-12-0

分子式C3H5N

分子量55.08

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  • Mass

    MS-NW-0774          
    propionitrile
    C3H5N               (Mass of molecular ion:     55)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       4.2
          25.0       1.8
          26.0      16.3
          27.0      14.7
          28.0     100.0
          29.0       2.6
          37.0       1.3
          38.0       2.1
          39.0       2.0
          40.0       4.2
          50.0       1.8
          51.0      10.2
          52.0      14.1
          53.0       8.8
          54.0      84.6
          55.0      15.6
          56.0       1.2
    

parameter in CDCl3

90 MHz in CDCl3


  • 1H NMR 300 MHz
    C3 H5 N 10 vol% in CCl4
    propionitrile
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 1.289 D(B) 2.311 J(A,B) 7.605 EBERSOLE,S. ET AL. J.PHYS.CHEM. 68, 3430 (1964)

         Hz     ppm     Int.
    

        704.84   2.349    146
        697.22   2.324    463
        689.62   2.299    486
        682.04   2.273    170
        394.21   1.314    509
        386.62   1.289   1000
        379.01   1.263    456
    


  • 1H NMR 89.56 MHz
    C3 H5 N 10.1 mol% in CDCl3
    propionitrile
    ChemicalStructure
        Assign.     Shift(ppm)
    A 1.30 B 2.36

         Hz     ppm     Int.
    

        223.63   2.497     99
        222.75   2.488     96
        215.44   2.406    364
        208.63   2.330    252
        207.81   2.321    443
        200.88   2.243    151
        200.06   2.234    137
        123.31   1.377    456
        116.06   1.296   1000
        115.50   1.290    603
        112.75   1.259     26
        108.19   1.209    316
        107.56   1.201    168
    

in CDCl3



liquid film



UV PHOTOLYSIS IN H2O2 AND H2O, 40C



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