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Butanoic acid, 2-methyl-, 3,4-dihydro-5-hydroxy-2-oxo-4-pentyl-2H-1-benzopyran-7-yl ester
SpectraBase Compound ID FOWF5ihjP3Z
InChI InChI=1S/C19H26O5/c1-4-6-7-8-13-9-17(21)24-16-11-14(10-15(20)18(13)16)23-19(22)12(3)5-2/h10-13,20H,4-9H2,1-3H3
InChIKey KAMZODBNBCXPQF-UHFFFAOYSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bGGkdUnZCj
Name Butanoic acid, 2-methyl-, 3,4-dihydro-5-hydroxy-2-oxo-4-pentyl-2H-1-benzopyran-7-yl ester
Alternate Name(s) 5-Hydroxy-2-oxo-4-pentyl-3,4-dihydro-2H-chromen-7-yl 2-methylbutanoate 5-Hydroxy-7-(2-methylbutyryloxy)-4-pentyl-3,4-dihydrocoumarin
CAS Registry Number 98192-76-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-4-6-7-8-13-9-17(21)24-16-11-14(10-15(20)18(13)16)23-19(22)12(3)5-2/h10-13,20H,4-9H2,1-3H3
InChIKey KAMZODBNBCXPQF-UHFFFAOYSA-N
Molecular Weight 334.412 g/mol
SMILES Oc1c2c(OC(CC2CCCCC)=O)cc(c1)OC(=O)C(CC)C
SPLASH splash10-004i-0930000000-875162024d055679f2fd
Source of Spectrum KC-1987-348-2
Wiley ID 1330977