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2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-7-hydroxy-5-methoxy-8-(1-oxobutyl)-
SpectraBase Compound ID 5Otw1NStCj8
InChI InChI=1S/C19H22O7/c1-5-7-12(21)18-13(22)9-15(24-4)17-11(8-16(23)26-19(17)18)14(6-2)25-10(3)20/h8-9,14,22H,5-7H2,1-4H3
InChIKey OGTYZBDKQRRASN-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 D3UyQsVM82T
Name 2H-1-Benzopyran-2-one, 4-[1-(acetyloxy)propyl]-7-hydroxy-5-methoxy-8-(1-oxobutyl)-
CAS Registry Number 111249-84-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O7
InChI InChI=1S/C19H22O7/c1-5-7-12(21)18-13(22)9-15(24-4)17-11(8-16(23)26-19(17)18)14(6-2)25-10(3)20/h8-9,14,22H,5-7H2,1-4H3
InChIKey OGTYZBDKQRRASN-UHFFFAOYSA-N
Molecular Weight 362.378 g/mol
SMILES Oc1cc(c2C(=CC(Oc2c1C(=O)CCC)=O)C(OC(=O)C)CC)OC
SPLASH splash10-07fr-0097000000-46866697ef54955140d3
Source of Spectrum KC-1987-341-16
Synonyms 1-(8-butyryl-7-hydroxy-5-methoxy-2-oxo-2H-chromen-4-yl)propyl acetate 4-(1-Acetoxypropyl)-8-butyryl-7-hydroxy-5-methoxycoumarin
Wiley ID 1349506