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2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-5,7-dihydroxy-6-(3-methyl-1-oxobutyl)-
SpectraBase Compound ID JkWxF0CU97r
InChI InChI=1S/C19H22O7/c1-5-14(25-10(4)20)11-7-16(23)26-15-8-13(22)18(19(24)17(11)15)12(21)6-9(2)3/h7-9,14,22,24H,5-6H2,1-4H3
InChIKey NPQUVZUZEWKMOK-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 DS34os4uVhG
Name 2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-5,7-dihydroxy-6-(3-methyl-1-oxobutyl)-
CAS Registry Number 111249-92-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O7
InChI InChI=1S/C19H22O7/c1-5-14(25-10(4)20)11-7-16(23)26-15-8-13(22)18(19(24)17(11)15)12(21)6-9(2)3/h7-9,14,22,24H,5-6H2,1-4H3
InChIKey NPQUVZUZEWKMOK-UHFFFAOYSA-N
Molecular Weight 362.378 g/mol
SMILES Oc1c(c(c2c(c1)OC(C=C2C(OC(=O)C)CC)=O)O)C(CC(C)C)=O
SPLASH splash10-0002-0093000000-296ab348583216796ad8
Source of Spectrum KC-1987-349-6
Synonyms 1-[5,7-dihydroxy-6-(3-methylbutanoyl)-2-oxo-2H-chromen-4-yl]propyl acetate 4-(1-Acetoxypropyl)-5,7-dihydroxy-6-(3-methylbutyryl)coumarin
Wiley ID 1349508