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Back ChemicalBook Home>CAS DataBase List>6291-84-5More Spectrum> N-METHYL-1,3-PROPANEDIAMINE(6291-84-5) 1H NMR

N-METHYL-1,3-PROPANEDIAMINE(6291-84-5) 1H NMR

Molecular FormulaC4H12N2

Molecular Weight88.15

InChIInChI=1S/C4H12N2/c1-6-4-2-3-5/h6H,2-5H2,1H3

InChIKey QHJABUZHRJTCAR-UHFFFAOYSA-N

SmilesC(NC)CCN


  • Mass

    MS-NW-2646          
    n-methyltrimethylenediamine
    C4H12N2             (Mass of molecular ion:     88)
    

       Source Temperature: 280 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       3.0
          17.0       1.1
          18.0       7.5
          27.0       2.2
          28.0      12.9
          29.0       2.7
          30.0      38.6
          31.0       6.8
          32.0       3.6
          39.0       1.1
          41.0       3.6
          42.0      11.8
          43.0       7.5
          44.0     100.0
          45.0       7.4
          56.0      15.0
          57.0      17.9
          58.0      10.4
          70.0       8.6
          71.0      42.8
          72.0       2.3
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C4 H12 N2 0.05 ml : 0.5 ml CDCl3
    N-methyltrimethylenediamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.77 B 2.64 C 2.43 D 1.63 E 1.36

         Hz     ppm     Int.
    

        254.63   2.844    125
        247.75   2.767    267
        243.31   2.717    181
        241.13   2.693    209
        236.56   2.642    271
        229.69   2.565    179
        224.50   2.507     39
        217.25   2.426   1000
        160.06   1.788     88
        159.19   1.778     95
        152.81   1.707    384
        145.94   1.630    483
        139.31   1.556    223
        138.75   1.550    226
        134.38   1.501     25
        132.56   1.481     69
        131.69   1.471     67
        129.50   1.446     28
        121.94   1.362    734
    

in CDCl3



liquid film





N-METHYL-1,3-PROPANEDIAMINE(6291-84-5) 1H NMR Atlas of Related Products

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