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2-[4-(Acetyloxy)phenyl]-3,6,8-trimethoxy-4-oxo-4H-chromen-5-yl acetate
SpectraBase Compound ID L6nTwT2yboA
InChI InChI=1S/C22H20O9/c1-11(23)29-14-8-6-13(7-9-14)19-22(28-5)18(25)17-20(30-12(2)24)15(26-3)10-16(27-4)21(17)31-19/h6-10H,1-5H3
InChIKey XPVFOXUHLIGRAK-UHFFFAOYSA-N
Mol Weight 428.39 g/mol
Molecular Formula C22H20O9
Exact Mass 428.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rSmZ6F8ffv
Name 2-[4-(Acetyloxy)phenyl]-3,6,8-trimethoxy-4-oxo-4H-chromen-5-yl acetate
CAS Registry Number 112667-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O9
InChI InChI=1S/C22H20O9/c1-11(23)29-14-8-6-13(7-9-14)19-22(28-5)18(25)17-20(30-12(2)24)15(26-3)10-16(27-4)21(17)31-19/h6-10H,1-5H3
InChIKey XPVFOXUHLIGRAK-UHFFFAOYSA-N
Molecular Weight 428.393 g/mol
SMILES CC(=O)Oc1ccc(cc1)C1=C(C(c2c(c(cc(c2OC(C)=O)OC)OC)O1)=O)OC
SPLASH splash10-000i-0109100000-eb70c8c77428e76e70f5
Source of Spectrum F-43-4246-4
Synonyms 3,6,8-Trimethoxy-2-(4-acetoxyphenyl)-5-acetoxy-4H-1-benzopyran-4-one Acetic acid [4-(5-acetyloxy-3,6,8-trimethoxy-4-oxo-1-benzopyran-2-yl)phenyl] ester [4-(5-acetyloxy-3,6,8-trimethoxy-4-oxochromen-2-yl)phenyl] acetate [4-(5-acetoxy-3,6,8-trimethoxy-4-oxo-chromen-2-yl)phenyl] acetate [4-(5-acetyloxy-3,6,8-trimethoxy-4-oxidanylidene-chromen-2-yl)phenyl] ethanoate
Wiley ID 1380629