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2-Hydroxy-2',3',5,5',6'-pentachlorobiphenyl, methyl ether
SpectraBase Compound ID 1hhm8OWmQCj
InChI InChI=1S/C13H7Cl5O/c1-19-10-3-2-6(14)4-7(10)11-12(17)8(15)5-9(16)13(11)18/h2-5H,1H3
InChIKey UGDCMDJNUIURIW-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C13H7Cl5O
Exact Mass 353.893953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JUUbC1OuRCR
Name 2-Hydroxy-2',3',5,5',6'-pentachlorobiphenyl, methyl ether
Comments Computed using HOSE algorithm
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Exact Mass 353.893953344 u
Formula C13H7Cl5O
InChI InChI=1S/C13H7Cl5O/c1-19-10-3-2-6(14)4-7(10)11-12(17)8(15)5-9(16)13(11)18/h2-5H,1H3
InChIKey UGDCMDJNUIURIW-UHFFFAOYSA-N
Molecular Weight 356.463 g/mol
SMILES C1(C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)=C(C=CC(=C1)Cl)OC