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Back ChemicalBook Home>CAS DataBase List>79-03-8More Spectrum> Propionyl chloride(79-03-8) MS

Propionyl chloride(79-03-8) MS

Product NamePropionyl chloride

CAS79-03-8

Molecular FormulaC3H5ClO

Molecular Weight92.52

InChIInChI=1S/C3H5ClO/c1-2-3(4)5/h2H2,1H3

InChIKey RZWZRACFZGVKFM-UHFFFAOYSA-N

SmilesC(Cl)(=O)CC


  • Mass

    MS-NW-2719          
    propionyl chloride
    C3H5ClO             (Mass of molecular ion:     92)
    

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

          14.0       2.2
          15.0       1.7
          25.0       3.0
          26.0      17.8
          27.0      59.9
          28.0      15.9
          29.0     100.0
          30.0       2.3
          35.0       2.2
          36.0       4.9
          37.0       1.3
          38.0       1.5
          39.0       1.3
          41.0       1.3
          42.0       4.0
          49.0       1.8
          53.0       1.1
          54.0       1.3
          55.0       3.4
          56.0       7.8
          57.0      99.1
          58.0       3.6
          63.0       8.4
          65.0       2.8
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C3 H5 Cl O 0.05 ml : 0.5 ml CDCl3
    propionyl chloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.93 B 1.24

         Hz     ppm     Int.
    

        273.81   3.058    108
        273.31   3.052     96
        266.13   2.972    388
        259.25   2.895    269
        258.75   2.890    438
        251.81   2.812    144
        251.31   2.807    124
        117.63   1.314    426
        110.44   1.234   1000
        108.13   1.208     26
        102.94   1.150    341
    

in CDCl3



liquid film





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