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2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-5,7-dimethoxy-8-(1-oxobutyl)-
SpectraBase Compound ID HoDemZBpGNx
InChI InChI=1S/C20H24O7/c1-6-8-13(22)19-16(25-5)10-15(24-4)18-12(9-17(23)27-20(18)19)14(7-2)26-11(3)21/h9-10,14H,6-8H2,1-5H3
InChIKey MESJCHLNDRSHHR-UHFFFAOYSA-N
Mol Weight 376.41 g/mol
Molecular Formula C20H24O7
Exact Mass 376.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlR5XGaWQhV
Name 2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-5,7-dimethoxy-8-(1-oxobutyl)-
Alternate Name(s) 1-(8-butyryl-5,7-dimethoxy-2-oxo-2H-chromen-4-yl)propyl acetate 4-(1-Acetoxypropyl)-8-butyryl-5,7-dimethoxycoumarin
CAS Registry Number 111249-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O7
InChI InChI=1S/C20H24O7/c1-6-8-13(22)19-16(25-5)10-15(24-4)18-12(9-17(23)27-20(18)19)14(7-2)26-11(3)21/h9-10,14H,6-8H2,1-5H3
InChIKey MESJCHLNDRSHHR-UHFFFAOYSA-N
Molecular Weight 376.405 g/mol
SMILES C=1(c2c(c(C(=O)CCC)c(cc2OC)OC)OC(C1)=O)C(OC(=O)C)CC
SPLASH splash10-001i-0049000000-5a39c9ce97c0387d92e0
Source of Spectrum KC-1987-340-16
Wiley ID 1357679