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Cyclocurcumin (IV) [1-(4'-Hydroxy-3'-methoxy)phenyl]-5-[2-(4"-hydroxy-3"-methoxyphenyl)ethenyl]-1,2-dihydropyran-3(H)-one]

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

Cyclocurcumin (IV) [1-(4'-Hydroxy-3'-methoxy)phenyl]-5-[2-(4"-hydroxy-3"-methoxyphenyl)ethenyl]-1,2-dihydropyran-3(H)-one]
SpectraBase Compound ID Bv7DwoAxQLM
InChI InChI=1S/C21H20O6/c1-25-20-9-13(4-7-17(20)23)3-6-16-11-15(22)12-19(27-16)14-5-8-18(24)21(10-14)26-2/h3-11,19,23-24H,12H2,1-2H3/b6-3+
InChIKey IZLBLUIBVMGMIY-ZZXKWVIFSA-N
Mol Weight 368.39 g/mol
Molecular Formula C21H20O6
Exact Mass 368.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQyiW0OSC8E
Name Cyclocurcumin (iv) [1-(4'-hydroxy-3'-methoxy)phenyl]-5-[2-(4''-hydroxy-3''-methoxyphenyl)ethenyl]-1,2-dihydropyran-3(H)-one]
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.125988358 u
Formula C21H20O6
InChI InChI=1S/C21H20O6/c1-25-20-9-13(4-7-17(20)23)3-6-16-11-15(22)12-19(27-16)14-5-8-18(24)21(10-14)26-2/h3-11,19,23-24H,12H2,1-2H3/b6-3+
InChIKey IZLBLUIBVMGMIY-ZZXKWVIFSA-N
Molecular Weight 368.385 g/mol
SMILES C=1(OC(CC(C1)=O)C1=CC(OC)=C(C=C1)O)\C=C\C=1C=C(OC)C(=CC1)O