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Back ChemicalBook Home>CAS DataBase List>108-23-6More Spectrum> Isopropyl chloroformate(108-23-6) IR1

Isopropyl chloroformate(108-23-6) IR1

Molecular FormulaC4H7ClO2

Molecular Weight122.55

InChIInChI=1S/C4H7ClO2/c1-3(2)7-4(5)6/h3H,1-2H3

InChIKey IVRIRQXJSNCSPQ-UHFFFAOYSA-N

SmilesC(Cl)(OC(C)C)=O


  • Mass

    MS-IW-3408          
    isopropyl chloroformate
    C4H7ClO2            (Mass of molecular ion:    122)
    

       Source Temperature: 220 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          14.0       1.0
          15.0       5.2
          26.0       2.4
          27.0      22.3
          28.0       3.3
          29.0       4.1
          35.0       2.1
          36.0       1.8
          37.0       1.7
          38.0       2.8
          39.0      12.2
          40.0       3.4
          41.0      39.8
          42.0      30.4
          43.0      98.3
          44.0       8.6
          45.0       1.7
          59.0       1.2
          63.0     100.0
          64.0       1.4
          65.0      38.9
          78.0       1.1
         107.0      63.6
         108.0       2.3
         109.0      21.0
    

parameter in CDCl3


  • 1H NMR 300 MHz
    C4 H7 Cl O2 0.05 ml : 0.5 ml CDCl3
    isopropyl chloroformate
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 5.079 D(B) 1.381 J(A,B) 6.35

         Hz     ppm     Int.
    

       1536.48   5.122     31
       1530.12   5.100     76
       1523.75   5.079    101
       1517.39   5.058     78
       1511.06   5.037     32
        417.49   1.392   1000
        411.13   1.370    991
    

in CDCl3



liquid film



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