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Polyester on the basis of 1,1'-binaphthyl-4,4'-diol and 1,1'-binaphthyl-4,4'-dicarboxylic acid
SpectraBase Compound ID ADUKr3g0h1P
InChI InChI=1S/C44H30O4/c1-27(45)28-19-20-35(30-12-4-3-11-29(28)30)36-21-22-41(34-16-6-5-13-31(34)36)44(46)48-43-26-24-38(33-15-8-10-18-40(33)43)37-23-25-42(47-2)39-17-9-7-14-32(37)39/h3-26H,1-2H3
InChIKey YLWXCUDXIVIQHN-UHFFFAOYSA-N
Mol Weight 622.7 g/mol
Molecular Formula C44H30O4
Exact Mass 622.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9T1zDKH8AX
Name Polyester on the basis of 1,1'-binaphthyl-4,4'-diol and 1,1'-binaphthyl-4,4'-dicarboxylic acid
Comments Computed using HOSE algorithm
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Exact Mass 622.214409442 u
Formula C44H30O4
InChI InChI=1S/C44H30O4/c1-27(45)28-19-20-35(30-12-4-3-11-29(28)30)36-21-22-41(34-16-6-5-13-31(34)36)44(46)48-43-26-24-38(33-15-8-10-18-40(33)43)37-23-25-42(47-2)39-17-9-7-14-32(37)39/h3-26H,1-2H3
InChIKey YLWXCUDXIVIQHN-UHFFFAOYSA-N
Molecular Weight 622.720 g/mol
Nominal Mass 622 u
SMILES C1(OC(=O)C2=CC=C(C=3C=CC=CC23)C2=CC=C(C(C)=O)C=3C=CC=CC23)=CC=C(C2=C1C=CC=C2)C1=CC=C(OC)C2=C1C=CC=C2