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5,5-Bis(4-methoxyphenyl)-1,3-diphenylpent-4-en-1-one

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5,5-Bis(4-methoxyphenyl)-1,3-diphenylpent-4-en-1-one
SpectraBase Compound ID 4h90AXpAjmF
InChI InChI=1S/C31H28O3/c1-33-28-17-13-24(14-18-28)30(25-15-19-29(34-2)20-16-25)21-27(23-9-5-3-6-10-23)22-31(32)26-11-7-4-8-12-26/h3-21,27H,22H2,1-2H3
InChIKey YRGPXHCPVURNEZ-UHFFFAOYSA-N
Mol Weight 448.56 g/mol
Molecular Formula C31H28O3
Exact Mass 448.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HgBnxWhUUp
Name 5,5-bis(4-Methoxyphenyl)-1,3-diphenylpent-4-en-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.203844759 u
Formula C31H28O3
InChI InChI=1S/C31H28O3/c1-33-28-17-13-24(14-18-28)30(25-15-19-29(34-2)20-16-25)21-27(23-9-5-3-6-10-23)22-31(32)26-11-7-4-8-12-26/h3-21,27H,22H2,1-2H3
InChIKey YRGPXHCPVURNEZ-UHFFFAOYSA-N
Molecular Weight 448.562 g/mol
SMILES C(CC(C=C(C=1C=CC(=CC1)OC)C=1C=CC(=CC1)OC)C=1C=CC=CC1)(=O)C=1C=CC=CC1