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4-(2',3',4',5',6'-Pentachlorophenoxy)-2,6-dichlorophenol
SpectraBase Compound ID DNSjUVRwKsB
InChI InChI=1S/C12H3Cl7O2/c13-4-1-3(2-5(14)11(4)20)21-12-9(18)7(16)6(15)8(17)10(12)19/h1-2,20H
InChIKey DBFIHLWPAXGTLU-UHFFFAOYSA-N
Mol Weight 427.3 g/mol
Molecular Formula C12H3Cl7O2
Exact Mass 423.795273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2JgDGlWTfP
Name 4-(2',3',4',5',6'-Pentachlorophenoxy)-2,6-dichlorophenol
Alternate Name(s) 2,6-dichloro-4-(2,3,4,5,6-pentachlorophenoxy)phenol
Comments Removed - expert review - solvent impurities
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Formula C12H3Cl7O2
InChI InChI=1S/C12H3Cl7O2/c13-4-1-3(2-5(14)11(4)20)21-12-9(18)7(16)6(15)8(17)10(12)19/h1-2,20H
InChIKey DBFIHLWPAXGTLU-UHFFFAOYSA-N
Molecular Weight 427.325 g/mol
SMILES Oc1c(cc(cc1Cl)Oc1c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)Cl
SPLASH splash10-0a6r-0109800000-fb1ea0a7438d78355bf1
Source of Spectrum SO-0-923-7
Wiley ID 1538691