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(+-)-6,6-Dimethyl-10-(2,2-dimethyl-3-hydroxybutanoyl)-9-hydroxy-4-propyl-2H,6H-benzo[1,2-b:3,4:b']dipyran-2-one
SpectraBase Compound ID HBmiUwsOgMg
InChI InChI=1S/C23H28O6/c1-7-8-13-11-15(25)28-20-16(13)19-14(9-10-22(3,4)29-19)18(26)17(20)21(27)23(5,6)12(2)24/h9-12,24,26H,7-8H2,1-6H3
InChIKey CKYLXONSZBPDTG-UHFFFAOYSA-N
Mol Weight 400.47 g/mol
Molecular Formula C23H28O6
Exact Mass 400.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VyD6HajgXG
Name (+-)-6,6-Dimethyl-10-(2,2-dimethyl-3-hydroxybutanoyl)-9-hydroxy-4-propyl-2H,6H-benzo[1,2-b:3,4:b']dipyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O6
InChI InChI=1S/C23H28O6/c1-7-8-13-11-15(25)28-20-16(13)19-14(9-10-22(3,4)29-19)18(26)17(20)21(27)23(5,6)12(2)24/h9-12,24,26H,7-8H2,1-6H3
InChIKey CKYLXONSZBPDTG-UHFFFAOYSA-N
Molecular Weight 400.471 g/mol
SMILES Oc1c2c(c3c(c1C(C(C(O)C)(C)C)=O)OC(C=C3CCC)=O)OC(C=C2)(C)C
SPLASH splash10-08fr-0009000000-78771e64772973ad0a9a
Source of Spectrum E1-40-1012-13
Synonyms 5-Hydroxy-6-(3-hydroxy-2,2-dimethyl-1-oxobutyl)-2,2-dimethyl-10-propyl-8-pyrano[2,3-f][1]benzopyranone 5-Hydroxy-6-(3-hydroxy-2,2-dimethylbutanoyl)-2,2-dimethyl-10-propylpyrano[2,3-f]chromen-8-one 6-(2,2-dimethyl-3-oxidanyl-butanoyl)-2,2-dimethyl-5-oxidanyl-10-propyl-pyrano[2,3-f]chromen-8-one
Wiley ID 1599206