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Poly(2,5-dihexadecyloxy-1,4-hydroquinone terephthalate)
SpectraBase Compound ID KGk88qjCveG
InChI InChI=1S/C48H78O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-52-45-40-47(54-48(50)43-35-33-42(34-36-43)41(3)49)46(39-44(45)51-4)53-38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h33-36,39-40H,5-32,37-38H2,1-4H3
InChIKey CDCPXDZOBLIABB-UHFFFAOYSA-N
Mol Weight 751.1 g/mol
Molecular Formula C48H78O6
Exact Mass 750.57984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eh3b1UjHU37
Name Poly(2,5-dihexadecyloxy-1,4-hydroquinone terephthalate)
Comments Computed using HOSE algorithm
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Exact Mass 750.579840226 u
Formula C48H78O6
InChI InChI=1S/C48H78O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-52-45-40-47(54-48(50)43-35-33-42(34-36-43)41(3)49)46(39-44(45)51-4)53-38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h33-36,39-40H,5-32,37-38H2,1-4H3
InChIKey CDCPXDZOBLIABB-UHFFFAOYSA-N
Molecular Weight 751.146 g/mol
Nominal Mass 750 u
SMILES C(OC1=CC(=C(C=C1OCCCCCCCCCCCCCCCC)OC)OCCCCCCCCCCCCCCCC)(C1=CC=C(C=C1)C(C)=O)=O