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Back ChemicalBook Home>CAS DataBase List>38379-99-6More Spectrum> 2,2',3,5',6-PENTACHLOROBIPHENYL(38379-99-6) 1H NMR

2,2',3,5',6-PENTACHLOROBIPHENYL(38379-99-6) 1H NMR

Product Name2,2',3,5',6-PENTACHLOROBIPHENYL

CAS38379-99-6

Molecular FormulaC12H5Cl5

Molecular Weight326.43

InChIInChI=1S/C12H5Cl5/c13-6-1-2-8(14)7(5-6)11-9(15)3-4-10(16)12(11)17/h1-5H

InChIKey GXNNLIMMEXHBKV-UHFFFAOYSA-N

SmilesC1(C2=CC(Cl)=CC=C2Cl)=C(Cl)C=CC(Cl)=C1Cl

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1HNMR

13CNMR

parameter in CDCl3


  • 1H NMR 300 MHz
    C12 H5 Cl5 0.73 mol% in CDCl3
    2,2',3,5',6-pentachlorobiphenyl
    ChemicalStructure 
        Parameter     ppm  Hz
    
      D(A)         7.465
      D(B)         7.362
       J(A,B)          8.69
     
      D(C)         7.443
      D(D)         7.360
      D(E)         7.197
       J(C,D)          8.58
       J(C,E)          0.31
       J(D,E)          2.52
     
     YANAGISAWA,M. ET AL. MAGN.RESON.CHEM. 25, 184 (1987)
  

         Hz     ppm     Int.


       2244.44   7.481    474
   2237.87   7.460    377
   2235.76   7.453    838
   2229.33   7.431    691
   2212.39   7.375   1000
   2210.38   7.368    483
   2203.67   7.346    541
   2201.81   7.339    262
   2160.29   7.201    556
   2157.85   7.193    507

in CDCl3



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2,2',3,5',6-PENTACHLOROBIPHENYL(38379-99-6) 1H NMR Atlas of Related Products

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