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4-Hydroxy-2',3',4',5'-tetrachlorobiphenyl, trimethylacetate

View entire compound with spectra: 1 NMR

4-Hydroxy-2',3',4',5'-tetrachlorobiphenyl, trimethylacetate
SpectraBase Compound ID GeQsEMyET6a
InChI InChI=1S/C17H14Cl4O2/c1-17(2,3)16(22)23-10-6-4-9(5-7-10)11-8-12(18)14(20)15(21)13(11)19/h4-8H,1-3H3
InChIKey RCDXQFQMKOXQLE-UHFFFAOYSA-N
Mol Weight 392.1 g/mol
Molecular Formula C17H14Cl4O2
Exact Mass 389.97479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A4hQH4UUJNy
Name 4-Hydroxy-2',3',4',5'-tetrachlorobiphenyl, trimethylacetate
Comments Computed using HOSE algorithm
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Exact Mass 389.974790489 u
Formula C17H14Cl4O2
InChI InChI=1S/C17H14Cl4O2/c1-17(2,3)16(22)23-10-6-4-9(5-7-10)11-8-12(18)14(20)15(21)13(11)19/h4-8H,1-3H3
InChIKey RCDXQFQMKOXQLE-UHFFFAOYSA-N
Molecular Weight 392.109 g/mol
SMILES C1(C2=C(C(=C(C(=C2)Cl)Cl)Cl)Cl)=CC=C(C=C1)OC(C(C)(C)C)=O