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网站主页CAS数据库列表 696-54-8更多图谱4-吡啶甲醛肟(696-54-8)核磁图(1HNMR)

4-吡啶甲醛肟

产品名称 4-吡啶甲醛肟

CAS号696-54-8

分子式C6H6N2O

分子量122.12

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  • Mass

    MS-NW-4676          
    isonicotinaldehyde oxime
    C6H6N2O             (Mass of molecular ion:    122)
    

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

          17.0       2.5
          18.0       9.5
          25.0       1.0
          26.0      10.0
          27.0       2.8
          28.0      13.4
          30.0       1.2
          36.0       1.2
          37.0       5.8
          38.0       8.2
          38.5       1.1
          39.0      15.9
          40.0       9.4
          41.0       8.8
          42.0       1.2
          44.0       2.9
          48.0       1.0
          49.0       5.2
          50.0      36.2
          51.0      65.0
          52.0      15.9
          53.0       5.2
          54.0       7.3
          55.0       1.1
          61.0       1.6
          62.0       2.9
          63.0       8.8
          64.0      12.4
          65.0      11.1
          66.0       6.6
          67.0      16.3
          68.0       9.7
          69.0       1.0
          75.0       5.9
          76.0      14.4
          77.0      38.4
          78.0      33.3
          79.0      12.3
          92.0       5.6
          93.0       9.8
          94.0      33.2
          95.0      10.4
         103.0       3.5
         104.0      51.9
         105.0       8.2
         106.0       7.3
         121.0       3.0
         122.0     100.0
         123.0       7.3
    

parameter in DMSO-d6

90 MHz in CDCl3


  • 1H NMR 300 MHz
    C6 H6 N2 O 30 % in DMSO
    isonicotinaldehyde oxime
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 8.83 D(B) 7.75 J(A,A') 0.4 J(A,B) 5.2 J(A,B') 0.8 J(A',B) 0.8 J(A',B') 5.2 J(B,B') 1.5 D(C) 8.40 D(D) 12.45 BRUEGEL,W. Z.ELEKTROCHEM.(BER.BUNSENGES.PHYS.CHEM.) 66, 159 (1962)

         Hz     ppm     Int.
    

       3735.01  12.450   1000
       2652.01   8.840    671
       2650.70   8.836    398
       2647.42   8.825    398
       2646.07   8.820    694
       2519.99   8.400   1000
       2327.97   7.760    695
       2326.66   7.756    407
       2323.33   7.744    398
       2322.02   7.740    671
    


  • 1H NMR 89.56 MHz
    C6 H6 N2 O 0.042 g : 0.5 ml CDCl3
    isonicotinaldehyde oxime
    ChemicalStructure
        Assign.     Shift(ppm)
    A 12. B 8.65 C 8.147 D 7.55

         Hz     ppm     Int.
    

        783.91   8.753     27
        783.23   8.746     29
        782.03   8.732     36
        781.69   8.729     38
        781.18   8.723     41
        780.75   8.718     46
        777.59   8.683    761
        776.05   8.666    448
        773.06   8.632    462
        771.44   8.614    846
        767.93   8.575     29
        729.65   8.148   1000
        681.63   7.611     27
        679.32   7.586    799
        677.70   7.567    478
        674.71   7.534    416
        673.08   7.516    746
        669.32   7.474     45
    

in CDCl3



KBr disc



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