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Back ChemicalBook Home>CAS DataBase List>77-04-3More Spectrum> PYRITHYLDIONE(77-04-3) 13C NMR

77-04-3

PYRITHYLDIONE(77-04-3) 13C NMR

Product NamePYRITHYLDIONE

CAS77-04-3

Molecular FormulaC9H13NO2

Molecular Weight167.21

  • PYRITHYLDIONE(77-04-3) <sup>13</sup>C NMR
    Mass

    MS-NW-9045          
    3,3-diethyl-2,4(1H,3H)-pyridinedione
    C9H13NO2            (Mass of molecular ion:    167)
    

       Source Temperature: 260 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          18.0       1.1
          27.0       5.1
          28.0       5.3
          29.0       6.9
          39.0       6.1
          40.0       3.3
          41.0      13.7
          42.0       6.5
          43.0       2.1
          53.0       4.0
          54.0       1.6
          55.0      38.4
          56.0       2.1
          65.0       1.6
          67.0       2.2
          68.0       2.7
          69.0       6.9
          70.0      48.6
          71.0       2.1
          82.0       1.1
          83.0      95.8
          84.0       5.3
          92.0       1.0
          96.0       4.1
          97.0       4.4
          98.0      82.8
          99.0       5.5
         120.0       1.8
         124.0      12.8
         125.0       1.0
         138.0      11.8
         139.0     100.0
         140.0       8.2
         150.0       3.0
         152.0      27.9
         153.0       2.7
         167.0      12.2
         168.0       1.4
    

parameter in CDCl3

  • PYRITHYLDIONE(77-04-3) <sup>13</sup>C NMR

    1H NMR 300 MHz
    C9 H13 N O2 2 M in CDCl3
    3,3-diethyl-2,4(1H,3H)-pyridinedione
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 7.30 D(B) 5.64 D(C) 9.55 J(A,B) 8.0 J(A,C) 6.0 J(B,C) 1.3 D(D) 1.98 D(E) 0.85 J(D,E) 7.5 OSTERCAMP,D.L. J.ORG.CHEM. 30, 1169 (1965)

         Hz     ppm     Int.
    

       2868.66   9.562     93
       2867.45   9.558     93
       2862.70   9.542     94
       2861.41   9.538     94
       2197.04   7.323     86
       2190.99   7.303     88
       2189.13   7.297     92
       2183.09   7.277     87
       1696.58   5.655     95
       1695.37   5.651     95
       1688.60   5.629     92
       1687.39   5.625     92
        605.37   2.018    138
        597.87   1.993    455
        590.37   1.968    490
        582.95   1.943    170
        262.38   0.875    501
        254.96   0.850   1000
        247.46   0.825    443
    

in CDCl3

  • PYRITHYLDIONE(77-04-3) <sup>13</sup>C NMR

KBr disc

  • PYRITHYLDIONE(77-04-3) <sup>13</sup>C NMR

nujol mull

  • PYRITHYLDIONE(77-04-3) <sup>13</sup>C NMR

PYRITHYLDIONE(77-04-3) 13C NMR Atlas of Related Products

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