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2H-1-Benzopyran-2-one, 5,7-dihydroxy-8-(2-methyl-1-oxobutyl)-4-(1-methylpropyl)-
SpectraBase Compound ID 8Z5Gyh77DNB
InChI InChI=1S/C18H22O5/c1-5-9(3)11-7-14(21)23-18-15(11)12(19)8-13(20)16(18)17(22)10(4)6-2/h7-10,19-20H,5-6H2,1-4H3
InChIKey ANSXBIQHPMNYBP-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlgNx7sPAIp
Name 2H-1-Benzopyran-2-one, 5,7-dihydroxy-8-(2-methyl-1-oxobutyl)-4-(1-methylpropyl)-
CAS Registry Number 98192-74-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-5-9(3)11-7-14(21)23-18-15(11)12(19)8-13(20)16(18)17(22)10(4)6-2/h7-10,19-20H,5-6H2,1-4H3
InChIKey ANSXBIQHPMNYBP-UHFFFAOYSA-N
Molecular Weight 318.369 g/mol
SMILES Oc1cc(c2c(c1C(=O)C(CC)C)OC(C=C2C(CC)C)=O)O
SPLASH splash10-03di-0092000000-9398f698070960c2f7e5
Source of Spectrum KC-1987-349-3
Synonyms 4-sec-butyl-5,7-dihydroxy-8-(2-methylbutanoyl)-2H-chromen-2-one 5,7-Dihydroxy-8-(2-methylbutyryl)-4-(1-methylpropyl)coumarin
Wiley ID 1318516