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Back ChemicalBook Home>CAS DataBase List>626-97-1More Spectrum> Pentanamide(626-97-1) 13C NMR

626-97-1

Pentanamide(626-97-1) 13C NMR

Product NamePentanamide

CAS626-97-1

Molecular FormulaC5H11NO

Molecular Weight101.15

InChIInChI=1S/C5H11NO/c1-2-3-4-5(6)7/h2-4H2,1H3,(H2,6,7)

InChIKey IPWFJLQDVFKJDU-UHFFFAOYSA-N

SmilesC(N)(=O)CCCC

  • Pentanamide(626-97-1) <sup>13</sup>C NMR
    Mass

    MS-NW-1271          
    valeramide
    C5H11NO             (Mass of molecular ion:    101)
    

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

          15.0       1.0
          18.0       2.8
          26.0       1.5
          27.0      10.8
          28.0       4.5
          29.0      19.0
          30.0       1.2
          39.0       5.6
          41.0      15.5
          42.0       3.9
          43.0       9.2
          44.0      38.9
          45.0       1.8
          54.0       1.1
          55.0       5.1
          56.0       1.4
          57.0      11.0
          59.0     100.0
          60.0       2.9
          72.0      18.5
          73.0       2.7
          85.0       2.3
          86.0       3.4
    

90 MHz in CDCl3

  • Pentanamide(626-97-1) <sup>13</sup>C NMR

    1H NMR 89.56 MHz
    C5 H11 N O 0.045 g : 0.5 ml CDCl3
    valeramide
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 6.4 B *1 5.9 C 2.22 D 1.60 E 1.37 F 0.93

         Hz     ppm     Int.
    

        207.25   2.315    179
        206.06   2.301    190
        199.38   2.227    433
        192.13   2.146    395
        152.56   1.704    174
        146.56   1.637    164
        145.75   1.628    204
        144.38   1.613    180
        142.25   1.589    160
        139.13   1.554    192
        137.88   1.540    259
        136.69   1.527    175
        135.88   1.518    152
        135.00   1.508    147
        131.94   1.474    276
        130.50   1.458    189
        126.56   1.414    162
        125.94   1.407    196
        125.31   1.400    175
        124.19   1.387    182
        119.88   1.339    151
        117.81   1.316    200
        111.50   1.245    161
        111.19   1.242    164
         89.81   1.003    334
         88.75   0.991    515
         82.50   0.922   1000
         76.44   0.854    168
         75.13   0.839    223
    

in CDCl3

  • Pentanamide(626-97-1) <sup>13</sup>C NMR

KBr disc

  • Pentanamide(626-97-1) <sup>13</sup>C NMR

nujol mull

  • Pentanamide(626-97-1) <sup>13</sup>C NMR

Pentanamide(626-97-1) 13C NMR Atlas of Related Products

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