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Back ChemicalBook Home>CAS DataBase List>6276-54-6More Spectrum> 3-Chloropropylamine hydrochloride(6276-54-6) 13C NMR

3-Chloropropylamine hydrochloride(6276-54-6) 13C NMR

Molecular FormulaC3H9Cl2N

Molecular Weight130.02

InChIInChI=1S/C3H8ClN.ClH/c4-2-1-3-5;/h1-3,5H2;1H

InChIKey IHPRVZKJZGXTBQ-UHFFFAOYSA-N

SmilesC(CCl)CN.Cl


  • Mass

    MS-NW-6996          
    3-chloropropylamine hydrochloride
    C3H8ClN HCl         (Mass of molecular ion:     93)
    

       Source Temperature: 150 °C
       Sample Temperature: 140 °C
       Direct, 75 eV
    

          18.0       2.5
          26.0       1.2
          27.0       2.8
          28.0       8.0
          29.0       1.8
          30.0     100.0
          31.0       2.1
          35.0       2.8
          36.0      21.8
          38.0       6.9
          39.0       1.5
          41.0       2.4
          42.0       1.7
          43.0       2.1
          56.0       2.1
          93.0       4.9
          95.0       1.7
    

400 MHz in DMSO-d6


  • 1H NMR 399.65 MHz
    C3 H8 Cl N 0.036 g : 0.5 ml DMSO-d6
    3-chloropropylamine hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.34 B 3.770 C 2.892 D 2.073

         Hz     ppm     Int.
    

       3332.06   8.338    357
       1513.37   3.787    529
       1506.96   3.771   1000
       1500.40   3.755    524
       1156.16   2.893    389
        842.13   2.108    147
        835.42   2.091    452
        828.55   2.074    602
        821.53   2.056    420
        814.67   2.039    132
    

D2O

in DMSO-d6





KBr disc



nujol mull





3-Chloropropylamine hydrochloride(6276-54-6) 13C NMR Atlas of Related Products

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