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Back ChemicalBook Home>CAS DataBase List>79-22-1More Spectrum> Methyl chloroformate(79-22-1) 13C NMR

Methyl chloroformate(79-22-1) 13C NMR

Product NameMethyl chloroformate

CAS79-22-1

Molecular FormulaC2H3ClO2

Molecular Weight94.5

InChIInChI=1S/C2H3ClO2/c1-5-2(3)4/h1H3

InChIKey XMJHPCRAQCTCFT-UHFFFAOYSA-N

SmilesC(Cl)(OC)=O


  • Mass

    MS-NW-0865          
    methyl chloroformate
    C2H3ClO2            (Mass of molecular ion:     94)
    

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

          14.0       1.8
          15.0      44.5
          28.0       6.4
          29.0      13.0
          30.0       2.4
          31.0       7.0
          35.0       4.7
          36.0       1.8
          37.0       1.5
          44.0       8.2
          45.0       5.0
          50.0       1.1
          59.0     100.0
          60.0       2.7
          63.0      38.7
          64.0       1.0
          65.0      12.6
          91.0       7.6
          92.0       5.1
          94.0       2.3
    

parameter in CDCl3


  • 1H NMR 300 MHz
    C2 H3 Cl O2 0.04 ml : 0.5 ml CDCl3
    methyl chloroformate
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 3.954

         Hz     ppm     Int.
    

       1186.20   3.954   1000
    

in CDCl3



CCl4 solution



liquid film



4880 A,100M,liquid



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