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2H-1-Benzopyran-2-one, 7-hydroxy-8-(2-methyl-1-oxobutyl)-5-(2-propenyloxy)-4-propyl-, (.+-.)-
SpectraBase Compound ID 7clL8t6uGFw
InChI InChI=1S/C20H24O5/c1-5-8-13-10-16(22)25-20-17(13)15(24-9-6-2)11-14(21)18(20)19(23)12(4)7-3/h6,10-12,21H,2,5,7-9H2,1,3-4H3
InChIKey NDDXLYNGQSAESU-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C20H24O5
Exact Mass 344.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKuhnprGK66
Name 2H-1-Benzopyran-2-one, 7-hydroxy-8-(2-methyl-1-oxobutyl)-5-(2-propenyloxy)-4-propyl-, (.+-.)-
CAS Registry Number 111761-38-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O5
InChI InChI=1S/C20H24O5/c1-5-8-13-10-16(22)25-20-17(13)15(24-9-6-2)11-14(21)18(20)19(23)12(4)7-3/h6,10-12,21H,2,5,7-9H2,1,3-4H3
InChIKey NDDXLYNGQSAESU-UHFFFAOYSA-N
Molecular Weight 344.407 g/mol
SMILES Oc1c(c2c(C(CCC)=CC(O2)=O)c(c1)OCC=C)C(=O)C(CC)C
SPLASH splash10-0f79-0098000000-1c271577b3274ecf1a4e
Source of Spectrum KC-1987-328-15
Synonyms 5-(allyloxy)-7-hydroxy-8-(2-methylbutanoyl)-4-propyl-2H-chromen-2-one 7-Hydroxy-8-(2-methylbutyryl)-5-(prop-2-enyloxy)-4-propyl-coumarin
Wiley ID 1338014