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3,3-Dicinnamyl-6-methyl-2,4-pyrandione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3,3-Dicinnamyl-6-methyl-2,4-pyrandione
SpectraBase Compound ID IB4HOIt0TfP
InChI InChI=1S/C24H22O3/c1-19-18-22(25)24(23(26)27-19,16-8-14-20-10-4-2-5-11-20)17-9-15-21-12-6-3-7-13-21/h2-15,18H,16-17H2,1H3/b14-8-,15-9+
InChIKey ATILFURCLIJKEW-DJJIWSAGSA-N
Mol Weight 358.44 g/mol
Molecular Formula C24H22O3
Exact Mass 358.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B7ZNxQDvnIB
Name 3,3-Dicinnamyl-6-methyl-2,4-pyrandione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.156894565 u
Formula C24H22O3
InChI InChI=1S/C24H22O3/c1-19-18-22(25)24(23(26)27-19,16-8-14-20-10-4-2-5-11-20)17-9-15-21-12-6-3-7-13-21/h2-15,18H,16-17H2,1H3/b14-8-,15-9+
InChIKey ATILFURCLIJKEW-DJJIWSAGSA-N
Molecular Weight 358.437 g/mol
SMILES C1(C(OC(=CC1=O)C)=O)(C\C=C/C=1C=CC=CC1)C\C=C\C=1C=CC=CC1