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Back ChemicalBook Home>CAS DataBase List>611-06-3More Spectrum> 2,4-Dichloronitrobenzene(611-06-3) IR1

2,4-Dichloronitrobenzene(611-06-3) IR1

Molecular FormulaC6H3Cl2NO2

Molecular Weight192

InChIInChI=1S/C6H3Cl2NO2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3H

InChIKey QUIMTLZDMCNYGY-UHFFFAOYSA-N

SmilesC1([N+]([O-])=O)=CC=C(Cl)C=C1Cl


  • Mass

    MS-NW-7626          
    2,4-dichloro-1-nitrobenzene
    C6H3Cl2NO2          (Mass of molecular ion:    191)
    

       Source Temperature: 250 °C
       Sample Temperature: 170 °C
       Reservoir, 75 eV
    

          26.0       1.1
          28.0       8.0
          30.0      44.7
          35.0       1.7
          36.0       6.8
          37.0      10.7
          38.0       6.2
          39.0       1.5
          44.0       1.3
          46.0       1.8
          47.0       2.1
          48.0       1.3
          49.0       5.9
          50.0      21.9
          51.0       3.6
          54.5       1.2
          55.0       1.0
          60.0       3.0
          61.0       6.5
          62.0       5.9
          63.0       9.2
          64.0       1.5
          71.0       1.0
          72.0       3.8
          73.0      19.2
          74.0      58.9
          75.0      46.3
          76.0       3.7
          83.0       3.8
          84.0      15.2
          85.0      12.3
          86.0       5.9
          87.0       4.6
          88.0       1.4
          97.0       3.0
          98.0       2.0
          99.0       1.2
         107.0       2.6
         108.0       3.4
         109.0     100.0
         110.0      20.9
         111.0      33.2
         112.0       6.7
         119.0       2.4
         121.0       1.6
         124.0       1.3
         126.0       1.6
         133.0      62.0
         134.0       3.8
         135.0      41.1
         136.0       2.5
         137.0       6.4
         144.0       1.7
         145.0      76.9
         146.0       6.3
         147.0      49.0
         148.0       3.7
         149.0       8.2
         161.0      62.7
         162.0       4.7
         163.0      40.8
         164.0       2.9
         165.0       6.7
         175.0       5.5
         177.0       3.8
         191.0      92.0
         192.0       7.0
         193.0      59.0
         194.0       4.6
         195.0      10.0
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C6 H3 Cl2 N O2 0.043 g : 0.5 ml CDCl3
    2,4-dichloro-1-nitrobenzene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.873 B 7.574 C 7.410 J(A,C)=8.7HZ. J(B,C)=2.2HZ.

         Hz     ppm     Int.
    

        710.31   7.932    566
        701.63   7.835    838
        679.56   7.588    717
        677.44   7.565   1000
        668.06   7.460    790
        665.88   7.436    573
        663.50   7.409     26
        659.38   7.363    508
        657.19   7.338    408
        655.44   7.319     28
    

in CDCl3



KBr disc





2,4-Dichloronitrobenzene(611-06-3) IR1 Atlas of Related Products

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