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4-hydroxy-3-[(4-hydroxy-3-methoxyphenyl)(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)methyl]-6-methyl-2H-pyran-2-one
SpectraBase Compound ID B4wRqkm50AT
InChI InChI=1S/C20H18O8/c1-9-6-13(22)17(19(24)27-9)16(11-4-5-12(21)15(8-11)26-3)18-14(23)7-10(2)28-20(18)25/h4-8,16,21-23H,1-3H3
InChIKey SFPIJCZKOBKTRH-UHFFFAOYSA-N
Mol Weight 386.36 g/mol
Molecular Formula C20H18O8
Exact Mass 386.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77u0sTj8r5w
Name 4-hydroxy-3-[(4-hydroxy-3-methoxyphenyl)(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)methyl]-6-methyl-2H-pyran-2-one
CAS Registry Number 82420-01-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O8
InChI InChI=1S/C20H18O8/c1-9-6-13(22)17(19(24)27-9)16(11-4-5-12(21)15(8-11)26-3)18-14(23)7-10(2)28-20(18)25/h4-8,16,21-23H,1-3H3
InChIKey SFPIJCZKOBKTRH-UHFFFAOYSA-N
Molecular Weight 386.356 g/mol
SMILES OC=1C=C(OC(C1C(c1ccc(c(c1)OC)O)C=1C(OC(=CC1O)C)=O)=O)C
SPLASH splash10-0006-9000000000-589a535b532929fac50a
Source of Spectrum Y-19-335-0
Synonyms 4-hydroxy-3-[(4-hydroxy-3-methoxyphenyl)-(4-hydroxy-6-methyl-2-oxo-3-pyranyl)methyl]-6-methyl-2-pyranone 4-hydroxy-3-[(4-hydroxy-3-methoxyphenyl)-(4-hydroxy-6-methyl-2-oxopyran-3-yl)methyl]-6-methylpyran-2-one 4-hydroxy-3-[(4-hydroxy-3-methoxy-phenyl)-(4-hydroxy-6-methyl-2-oxo-pyran-3-yl)methyl]-6-methyl-pyran-2-one 3-[(3-methoxy-4-oxidanyl-phenyl)-(6-methyl-4-oxidanyl-2-oxidanylidene-pyran-3-yl)methyl]-6-methyl-4-oxidanyl-pyran-2-one
Wiley ID 1362537