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Back ChemicalBook Home>CAS DataBase List>754-10-9More Spectrum> PIVALAMIDE(754-10-9) 13C NMR

PIVALAMIDE(754-10-9) 13C NMR

Product NamePIVALAMIDE

CAS754-10-9

Molecular FormulaC5H11NO

Molecular Weight101.15

InChIInChI=1S/C5H11NO/c1-5(2,3)4(6)7/h1-3H3,(H2,6,7)

InChIKey XIPFMBOWZXULIA-UHFFFAOYSA-N

SmilesC(N)(=O)C(C)(C)C


  • Mass

    MS-NW-1272          
    pivalamide
    C5H11NO             (Mass of molecular ion:    101)
    

       Source Temperature: 240 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       1.7
          27.0       7.2
          28.0       1.8
          29.0      38.8
          30.0       1.3
          38.0       1.2
          39.0      11.8
          40.0       1.9
          41.0      54.5
          42.0       5.6
          43.0       1.9
          44.0      16.2
          45.0       1.1
          46.0      22.0
          55.0       3.3
          56.0       6.7
          57.0     100.0
          58.0       9.0
          59.0       3.3
          68.0       1.0
          69.0       3.2
          86.0       8.9
         101.0      15.6
         102.0       1.1
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C5 H11 N O 0.048 g : 0.5 ml CDCl3
    pivalamide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6. B 1.219

         Hz     ppm     Int.
    

        109.19   1.220   1000
    

in CDCl3



KBr disc



nujol mull





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