PENTACHLOROPHENYL DICHLOROACETATE(19745-69-8) IR1
Molecular FormulaC8HCl7O2
Molecular Weight377.26
InChIInChI=1S/C8HCl7O2/c9-1-2(10)4(12)6(5(13)3(1)11)17-8(16)7(14)15/h7H
InChIKey KDDDLTRKFSGKHG-UHFFFAOYSA-N
SmilesC(OC1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl)(=O)C(Cl)Cl
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Parameter ppm Hz
D(A) 6.255
Spectral Code: 1H NMR : parameter in CDCl3
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ppm Int. Assign.
160.25 670 1
142.72 265 2
132.68 330 3
132.38 620 4 *
127.39 650 5 *
63.11 1000 6
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : KBr disc