2,3,4,5-TETRACHLOROBIPHENYL(33284-53-6) 1H NMR
Molecular FormulaC12H6Cl4
Molecular Weight291.99
InChIInChI=1S/C12H6Cl4/c13-9-6-8(7-4-2-1-3-5-7)10(14)12(16)11(9)15/h1-6H
InChIKey HLQDGCWIOSOMDP-UHFFFAOYSA-N
SmilesC1(C2=CC=CC=C2)=CC(Cl)=C(Cl)C(Cl)=C1Cl
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Parameter ppm Hz
D(A) 7.384
D(B) 7.360
D(C) 7.432
D(D) 7.408
J(B,B') 1.96
J(B,C) 7.77
J(B,C') 0.59
J(B,D) 1.24
J(B',C) 0.59
J(B',C') 7.77
J(B',D) 1.24
J(C,C') 1.40
J(C,D) 7.54
J(C',D) 7.54
YANAGISAWA,M. MAGN.RESON.CHEM. 25, 184 (1987)
Spectral Code: 1H NMR : parameter in CDCl3
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ppm Int. Assign.
140.93 144 1
137.50 163 2
133.59 95 3
131.73 161 4
131.60 102 5
131.06 109 6
129.56 502 7
128.75 1000 8
128.22 523 9
128.03 949 10
Spectral Code: 13C NMR : in CDCl3