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Back ChemicalBook Home>CAS DataBase List>814-68-6More Spectrum> Acryloyl chloride(814-68-6) IR1

Acryloyl chloride(814-68-6) IR1

Product NameAcryloyl chloride

CAS814-68-6

Molecular FormulaC3H3ClO

Molecular Weight90.51

InChIInChI=1S/C3H3ClO/c1-2-3(4)5/h2H,1H2

InChIKey HFBMWMNUJJDEQZ-UHFFFAOYSA-N

SmilesC(Cl)(=O)C=C


  • Mass

    MS-NW-0948          
    acryloyl chloride
    C3H3ClO             (Mass of molecular ion:     90)
    

       Source Temperature: 280 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          24.0       1.6
          25.0       6.8
          26.0      20.4
          27.0      67.0
          28.0       4.5
          29.0       1.3
          35.0       3.1
          36.0       3.1
          37.0       2.1
          38.0       1.4
          53.0       3.1
          54.0       1.1
          55.0     100.0
          56.0       3.3
          62.0       9.0
          63.0       6.0
          64.0       2.8
          65.0       1.9
          91.0       1.3
    

parameter in CDCl3


  • 1H NMR 300 MHz
    C3 H3 Cl O 20 wt% in CDCl3
    acryloyl chloride
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 6.16 D(B) 6.63 D(C) 6.35 J(A,B) 0.2 J(A,C) 10.6 J(B,C) 17.4 BRUEGEL,W. HANDBOOK OF NMR SPECTRAL PARAMETERS 40.2.9.3

         Hz     ppm     Int.
    

       1998.43   6.661    669
       1981.18   6.604   1000
       1918.48   6.395    592
       1907.99   6.360    781
       1901.23   6.337    342
       1890.74   6.302    572
       1852.65   6.175    989
       1842.36   6.141    683
    

in CDCl3



liquid film





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