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594-20-7

2,2-二氯丙烷(594-20-7)质谱(MS)

产品名称:2,2-二氯丙烷

CAS:594-20-7

分子式:C3H6Cl2

分子量: 112.99

InChI:InChI=1S/C3H6Cl2/c1-3(2,4)5/h1-2H3

InChIKey: ZEOVXNVKXIPWMS-UHFFFAOYSA-N

Smiles:CC(Cl)(Cl)C

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    Mass

    MS-NW-4425          
    2,2-dichloropropane
    C3H6Cl2             (Mass of molecular ion:    112)
    

       Source Temperature: 230 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          15.0       2.0
          26.0       3.1
          27.0       6.0
          35.0       2.1
          36.0       2.3
          37.0       3.6
          38.0       5.2
          39.0      20.1
          40.0       2.7
          41.0      59.4
          42.0       2.7
          49.0       5.4
          51.0       1.8
          60.0       1.2
          61.0      15.0
          62.0       3.1
          63.0       6.7
          64.0       1.1
          75.0       1.2
          76.0       2.8
          77.0     100.0
          78.0       4.4
          79.0      32.5
          80.0       1.2
          96.0       1.0
          97.0      20.5
          98.0       1.0
          99.0      12.9
         101.0       2.1
    

parameter in CCl4

parameter in CDCl3

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    1H NMR 300 MHz
    C3 H6 Cl2 10 vol% in CCl4
    2,2-dichloropropane
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 2.21 WHITE,H.F. ANAL.CHEM. 36, 1291 (1964)

         Hz     ppm     Int.
    

        663.00   2.210   1000
    

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    1H NMR 300 MHz
    C3 H6 Cl2 0.04 ml : 0.5 ml CDCl3
    2,2-dichloropropane
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 2.193

         Hz     ppm     Int.
    

        657.90   2.193   1000
    

in CDCl3

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CCl4 solution

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liquid film

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4880 A,200 M,liquid

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