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网站主页CAS数据库列表 5470-18-8更多图谱2-氯-3-硝基吡啶(5470-18-8)质谱(MS)

2-氯-3-硝基吡啶

产品名称 2-氯-3-硝基吡啶

CAS号5470-18-8

分子式C5H3ClN2O2

分子量158.54


  • Mass

    MS-NW-7243          
    2-chloro-3-nitropyridine
    C5H3ClN2O2          (Mass of molecular ion:    158)
    

       Source Temperature: 200 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          26.0       3.8
          27.0       1.0
          28.0       3.0
          30.0       7.5
          36.0       1.1
          37.0       3.1
          38.0       4.8
          39.0       4.6
          46.0       1.2
          47.0       1.3
          49.0       4.0
          50.0      20.2
          51.0      18.3
          52.0       3.8
          61.0       3.4
          62.0       5.7
          63.0       1.8
          64.0       2.3
          75.0       4.1
          76.0      57.9
          77.0       5.2
          84.0       3.5
          85.0      20.6
          86.0       3.4
          87.0       6.9
         100.0       9.1
         102.0       3.0
         112.0     100.0
         113.0       6.2
         114.0      32.7
         115.0       2.0
         158.0      48.7
         159.0       3.6
         160.0      16.0
         161.0       1.2
    

90 MHz in CDCl3

parameter in acetone


  • 1H NMR 89.56 MHz
    C5 H3 Cl N2 O2 0.042 g : 0.5 ml CDCl3
    2-chloro-3-nitropyridine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.644 B 8.251 C 7.507 J(A,B)=1.8HZ J(A,C)=4.7HZ J(B,C)=8.0HZ

         Hz     ppm     Int.
    

        777.56   8.683    455
        775.81   8.663    508
        772.88   8.630    509
        771.13   8.611    536
        744.31   8.311    570
        742.56   8.292    533
        736.31   8.222    714
        734.50   8.202    651
        678.25   7.574   1000
        676.38   7.553     64
        675.75   7.546     64
        673.56   7.521    949
        670.25   7.484    828
        668.38   7.463     60
        667.19   7.450     64
        665.50   7.431    754
    


  • 1H NMR 300 MHz
    C5 H3 Cl N2 O2 ca 7 wt% in acetone
    2-chloro-3-nitropyridine
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 8.702 D(B) 7.733 D(C) 8.473 J(A,B) 4.75 J(A,C) 1.73 J(B,C) 7.97 GERIG,J.T. & REINHEIMER,J.D. ORG.MAGN.RESON. 1, 239 (1969)

         Hz     ppm     Int.
    

       2613.87   8.713    911
       2612.15   8.707    963
       2609.12   8.697    951
       2607.40   8.691    984
       2546.81   8.489    928
       2545.09   8.484    890
       2538.84   8.463   1000
       2537.12   8.457    952
       2326.17   7.754    954
       2321.42   7.738    934
       2318.21   7.727    899
       2313.46   7.712    860
    

in CDCl3



KBr disc



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