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1,5-Bis(4-methoxyphenyl)-2,4-diphenoxypentane-1,5-dione

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1,5-Bis(4-methoxyphenyl)-2,4-diphenoxypentane-1,5-dione
SpectraBase Compound ID JoC7sV46VVr
InChI InChI=1S/C31H28O6/c1-34-24-17-13-22(14-18-24)30(32)28(36-26-9-5-3-6-10-26)21-29(37-27-11-7-4-8-12-27)31(33)23-15-19-25(35-2)20-16-23/h3-20,28-29H,21H2,1-2H3
InChIKey PLOJPFZRLRMSNV-UHFFFAOYSA-N
Mol Weight 496.56 g/mol
Molecular Formula C31H28O6
Exact Mass 496.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID tLvZiiUcpH
Name 1,5-bis(4-Methoxyphenyl)-2,4-diphenoxypentane-1,5-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 496.188588616 u
Formula C31H28O6
InChI InChI=1S/C31H28O6/c1-34-24-17-13-22(14-18-24)30(32)28(36-26-9-5-3-6-10-26)21-29(37-27-11-7-4-8-12-27)31(33)23-15-19-25(35-2)20-16-23/h3-20,28-29H,21H2,1-2H3
InChIKey PLOJPFZRLRMSNV-UHFFFAOYSA-N
Molecular Weight 496.559 g/mol
SMILES C(C(CC(C(=O)C=1C=CC(=CC1)OC)OC=1C=CC=CC1)OC=1C=CC=CC1)(=O)C=1C=CC(=CC1)OC