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Poly(4,4'-dihydroxytetraphenylmethane terephthalate)
SpectraBase Compound ID BZm3ST3z3sr
InChI InChI=1S/C35H28O4/c1-25(36)26-13-15-27(16-14-26)34(37)39-33-23-19-31(20-24-33)35(28-9-5-3-6-10-28,29-11-7-4-8-12-29)30-17-21-32(38-2)22-18-30/h3-24H,1-2H3
InChIKey ULOMGALWFIVKDK-UHFFFAOYSA-N
Mol Weight 512.6 g/mol
Molecular Formula C35H28O4
Exact Mass 512.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BD6RBjU2NQN
Name Poly(4,4'-dihydroxytetraphenylmethane terephthalate)
Comments Computed using HOSE algorithm
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Exact Mass 512.198759378 u
Formula C35H28O4
InChI InChI=1S/C35H28O4/c1-25(36)26-13-15-27(16-14-26)34(37)39-33-23-19-31(20-24-33)35(28-9-5-3-6-10-28,29-11-7-4-8-12-29)30-17-21-32(38-2)22-18-30/h3-24H,1-2H3
InChIKey ULOMGALWFIVKDK-UHFFFAOYSA-N
Molecular Weight 512.605 g/mol
Nominal Mass 512 u
SMILES C(C=1C=CC(=CC1)C(C)=O)(=O)OC1=CC=C(C=C1)C(C1=CC=C(C=C1)OC)(C=1C=CC=CC1)C=1C=CC=CC1