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Oxyresveratrol, tetraacetate
SpectraBase Compound ID CfwRKsKNESK
InChI InChI=1S/C22H20O8/c1-13(23)27-19-8-7-18(22(12-19)30-16(4)26)6-5-17-9-20(28-14(2)24)11-21(10-17)29-15(3)25/h5-12H,1-4H3/b6-5+
InChIKey XBKFUPHXRRKXGW-AATRIKPKSA-N
Mol Weight 412.39 g/mol
Molecular Formula C22H20O8
Exact Mass 412.115818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CGVKe9Y74cd
Name Oxyresveratrol, tetraacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.115817596 u
Formula C22H20O8
InChI InChI=1S/C22H20O8/c1-13(23)27-19-8-7-18(22(12-19)30-16(4)26)6-5-17-9-20(28-14(2)24)11-21(10-17)29-15(3)25/h5-12H,1-4H3/b6-5+
InChIKey XBKFUPHXRRKXGW-AATRIKPKSA-N
Molecular Weight 412.394 g/mol
SMILES C1(OC(=O)C)=CC(OC(=O)C)=C(C=C1)\C=C\C=1C=C(C=C(OC(=O)C)C1)OC(=O)C