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Xanthohumol, trimethyl ether

View entire compound with spectra: 1 NMR, and 1 FTIR

Xanthohumol, trimethyl ether
SpectraBase Compound ID 1uKam5zDTO5
InChI InChI=1S/C24H28O5/c1-16(2)7-13-19-21(27-4)15-22(28-5)23(24(19)29-6)20(25)14-10-17-8-11-18(26-3)12-9-17/h7-12,14-15H,13H2,1-6H3/b14-10+
InChIKey GGNVSANPVOEGII-GXDHUFHOSA-N
Mol Weight 396.48 g/mol
Molecular Formula C24H28O5
Exact Mass 396.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1NjIV1hwBlp
Name Xanthohumol, trimethyl ether
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.193673997 u
Formula C24H28O5
InChI InChI=1S/C24H28O5/c1-16(2)7-13-19-21(27-4)15-22(28-5)23(24(19)29-6)20(25)14-10-17-8-11-18(26-3)12-9-17/h7-12,14-15H,13H2,1-6H3/b14-10+
InChIKey GGNVSANPVOEGII-GXDHUFHOSA-N
Molecular Weight 396.483 g/mol
SMILES C(\C=C\C1=CC=C(C=C1)OC)(=O)C1=C(OC)C=C(OC)C(=C1OC)CC=C(C)C