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13116-53-5

四氯丙烷(13116-53-5)核磁图(1HNMR)

产品名称:四氯丙烷

CAS:13116-53-5

分子式:C3H4Cl4

分子量: 181.88

InChI:InChI=1S/C3H4Cl4/c4-1-3(6,7)2-5/h1-2H2

InChIKey: UDPHJTAYHSSOQB-UHFFFAOYSA-N

Smiles:C(Cl)C(Cl)(Cl)CCl

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    Mass

    MS-NW-0957          
    1,2,2,3-tetrachloropropane
    C3H4Cl4             (Mass of molecular ion:    180)
    

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

          25.0       1.5
          26.0       4.6
          27.0       1.3
          35.0       3.7
          36.0       6.3
          37.0      10.4
          38.0      13.7
          39.0      28.6
          40.0       2.8
          47.0       5.0
          48.0       3.1
          49.0      47.7
          50.0       1.5
          51.0      15.0
          60.0       4.7
          61.0      11.8
          62.0       2.0
          63.0       3.9
          72.0       1.9
          73.0      11.0
          74.0       1.4
          75.0      12.6
          77.0       3.4
          83.0      32.8
          85.0      20.3
          87.0       3.4
          95.0      31.0
          96.0      17.7
          97.0      19.8
          98.0      10.9
          99.0       3.5
         100.0       1.6
         109.0      35.7
         110.0       2.1
         111.0      22.8
         112.0       1.4
         113.0       3.7
         130.0      24.4
         131.0     100.0
         132.0      25.1
         133.0      92.7
         134.0       9.3
         135.0      29.1
         136.0       1.4
         137.0       3.2
         144.0      15.4
         145.0      35.6
         146.0      15.8
         147.0      32.3
         148.0       6.0
         149.0      10.6
         151.0       1.1
    

parameter in CCl4

parameter in CDCl3

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    1H NMR 300 MHz
    C3 H4 Cl4 10 vol% in CCl4
    1,2,2,3-tetrachloropropane
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 4.17 WHITE,H.F. ANAL.CHEM. 36, 1291 (1964)

         Hz     ppm     Int.
    

       1251.00   4.170   1000
    

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    1H NMR 300 MHz
    C3 H4 Cl4 0.02 ml : 0.5 ml CDCl3
    1,2,2,3-tetrachloropropane
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 4.129

         Hz     ppm     Int.
    

       1238.70   4.129   1000
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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