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5,5'-Dihydroxy-3,3'-dimethyl-2,2'-binaphthalene-1,1',4,4'-tetrone
SpectraBase Compound ID AeUY8R5RuVt
InChI InChI=1S/C22H14O6/c1-9-15(21(27)11-5-3-7-13(23)17(11)19(9)25)16-10(2)20(26)18-12(22(16)28)6-4-8-14(18)24/h3-8,23-24H,1-2H3
InChIKey ZVYRZPLFQREFMA-UHFFFAOYSA-N
Mol Weight 374.35 g/mol
Molecular Formula C22H14O6
Exact Mass 374.079038 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGmyNMxseIZ
Name 5,5'-Dihydroxy-3,3'-dimethyl-2,2'-binaphthalene-1,1',4,4'-tetrone
Comments Computed using HOSE algorithm
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Exact Mass 374.079038165 u
Formula C22H14O6
InChI InChI=1S/C22H14O6/c1-9-15(21(27)11-5-3-7-13(23)17(11)19(9)25)16-10(2)20(26)18-12(22(16)28)6-4-8-14(18)24/h3-8,23-24H,1-2H3
InChIKey ZVYRZPLFQREFMA-UHFFFAOYSA-N
Molecular Weight 374.348 g/mol
SMILES C1=CC=C(C2=C1C(C(=C(C2=O)C)C=1C(C2=C(C(=CC=C2)O)C(C1C)=O)=O)=O)O