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Poly(terephthalic acid-co-4-hydroxybenzoic acid-co-2,7-dihydroxynaphthalene), 35:40:25
SpectraBase Compound ID EriL7TglM8P
InChI InChI=1S/C12H12O2.C10H10O2.C9H10O2/c1-13-11-5-3-9-4-6-12(14-2)8-10(9)7-11;1-7(11)9-3-5-10(6-4-9)8(2)12;1-7(10)8-3-5-9(11-2)6-4-8/h3-8H,1-2H3;3-6H,1-2H3;3-6H,1-2H3
InChIKey ZGRMXXUOOKCCIJ-UHFFFAOYSA-N
Mol Weight 500.59 g/mol
Molecular Formula C31H32O6
Exact Mass 500.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XKrhqgAAHH
Name Poly(terephthalic acid-co-4-hydroxybenzoic acid-co-2,7-dihydroxynaphthalene), 35:40:25
Comments Computed using HOSE algorithm
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Exact Mass 500.219888744 u
Formula C31H32O6
InChI InChI=1S/C12H12O2.C10H10O2.C9H10O2/c1-13-11-5-3-9-4-6-12(14-2)8-10(9)7-11;1-7(11)9-3-5-10(6-4-9)8(2)12;1-7(10)8-3-5-9(11-2)6-4-8/h3-8H,1-2H3;3-6H,1-2H3;3-6H,1-2H3
InChIKey ZGRMXXUOOKCCIJ-UHFFFAOYSA-N
Molecular Weight 500.591 g/mol
Nominal Mass 500 u
SMILES C=1C=C(C=CC1C(=O)C)C(=O)C.C=1(C=CC=2C=CC(OC)=CC2C1)OC.COC1=CC=C(C(C)=O)C=C1