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2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-5,7-dihydroxy-8-(3-methyl-1-oxobutyl)-, (.+-.)-
SpectraBase Compound ID AY9yLF82DNC
InChI InChI=1S/C19H22O7/c1-5-15(25-10(4)20)11-7-16(24)26-19-17(11)13(22)8-14(23)18(19)12(21)6-9(2)3/h7-9,15,22-23H,5-6H2,1-4H3
InChIKey NHHZENHQXHACJL-UHFFFAOYSA-N
Mol Weight 362.38 g/mol
Molecular Formula C19H22O7
Exact Mass 362.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmnKTAqm9n5
Name 2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-5,7-dihydroxy-8-(3-methyl-1-oxobutyl)-, (.+-.)-
CAS Registry Number 98498-78-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O7
InChI InChI=1S/C19H22O7/c1-5-15(25-10(4)20)11-7-16(24)26-19-17(11)13(22)8-14(23)18(19)12(21)6-9(2)3/h7-9,15,22-23H,5-6H2,1-4H3
InChIKey NHHZENHQXHACJL-UHFFFAOYSA-N
Molecular Weight 362.378 g/mol
SMILES Oc1cc(c(c2OC(C=C(c12)C(OC(=O)C)CC)=O)C(CC(C)C)=O)O
SPLASH splash10-0002-0091000000-6f50fa063b2b9c1aecc9
Source of Spectrum KC-1987-349-6
Synonyms 1-[5,7-dihydroxy-8-(3-methylbutanoyl)-2-oxo-2H-chromen-4-yl]propyl acetate 4-(1-Acetoxypropyl)-5,7-dihydroxy-8-(3-methylbutyryl)coumarin
Wiley ID 1349507