2,2',4,5'-TETRACHLOROBIPHENYL(41464-40-8) 1H NMR
Molecular FormulaC12H6Cl4
Molecular Weight291.99
InChIInChI=1S/C12H6Cl4/c13-7-2-4-11(15)10(5-7)9-3-1-8(14)6-12(9)16/h1-6H
InChIKey ZWPVHELAQPIZHO-UHFFFAOYSA-N
SmilesC1(C2=CC(Cl)=CC=C2Cl)=CC=C(Cl)C=C1Cl
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Parameter ppm Hz
D(A) 7.500
D(B) 7.310
D(C) 7.175
J(A,B) 2.10
J(A,C) 0.35
J(B,C) 8.23
D(D) 7.396
D(E) 7.310
D(F) 7.241
J(D,E) 8.59
J(D,F) 0.35
J(E,F) 2.55
YANAGISAWA,M. ET AL. MAGN.RESON.CHEM. 25, 184 (1987)
Spectral Code: 1H NMR : parameter in CDCl3
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ppm Int. Assign.
138.44 214 1
135.43 213 2
134.75 248 3
134.03 211 4
132.21 259 5
131.73 231 6
131.43 825 7
130.73 811 8
130.32 820 9
129.25 949 10
129.23 1000 11
126.73 750 12
Spectral Code: 13C NMR : in CDCl3