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2-[(E)-2-[3,4-bis(phenylmethoxy)phenyl]ethenyl]-7-phenylmethoxy-1-benzopyran-4-one

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2-[(E)-2-[3,4-bis(phenylmethoxy)phenyl]ethenyl]-7-phenylmethoxy-1-benzopyran-4-one
SpectraBase Compound ID 8ATs20HXywq
InChI InChI=1S/C38H30O5/c39-35-23-33(43-37-24-32(19-20-34(35)37)40-25-29-10-4-1-5-11-29)18-16-28-17-21-36(41-26-30-12-6-2-7-13-30)38(22-28)42-27-31-14-8-3-9-15-31/h1-24H,25-27H2/b18-16+
InChIKey SKSURBZWBMABNP-FBMGVBCBSA-N
Mol Weight 566.7 g/mol
Molecular Formula C38H30O5
Exact Mass 566.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAR8iu1SmC3
Name 2-[(E)-2-[3,4-bis(Phenylmethoxy)phenyl]ethenyl]-7-phenylmethoxy-1-benzopyran-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 566.209324061 u
Formula C38H30O5
InChI InChI=1S/C38H30O5/c39-35-23-33(43-37-24-32(19-20-34(35)37)40-25-29-10-4-1-5-11-29)18-16-28-17-21-36(41-26-30-12-6-2-7-13-30)38(22-28)42-27-31-14-8-3-9-15-31/h1-24H,25-27H2/b18-16+
InChIKey SKSURBZWBMABNP-FBMGVBCBSA-N
Molecular Weight 566.653 g/mol
SMILES C12=C(C(=O)C=C(O2)\C=C\C=2C=C(OCC3=CC=CC=C3)C(=CC2)OCC2=CC=CC=C2)C=CC(=C1)OCC=1C=CC=CC1