title: (1)H and (13)C NMR spectral data for a tricyclic derivative of a Diels-Alder adduct.
abstract: A complete NMR analysis with full assignment for (1)H and (13)C NMR spectral data for 5-(acetyloxy)-3-hydroxy-9,10-dimethoxy-6-oxo-11-oxatricyclo[6.2.1.0(2,7)]undec-2-yl acetate is described. This compound was prepared by rapid hydrogenation of the unstable Diels-Alder adduct obtained from the reaction between 3,4-dimethoxyfuran and 2,5-diacetoxy-1,4-benzoquinone. Full homonuclear hydrogen coupling constants measurements and molecular mechanics calculations were performed for the determination of the relative stereochemistry.
authors.affiliation: Departamento de Química, Faculdade de Filosofia, Ciências e Letras de Ribeirão Preto, Universidade de São Paulo, Avenida Bandeirantes 3900, 14040-901 Ribeirão Preto, SP, Brazil. mgconsta@usp.br
authors.forename: Susimaire
authors.initials: S
authors.lastname: Pedersoli
authors.forename: Mauricio Gomes
authors.initials: MG
authors.lastname: Constantino
authors.forename: Gil Valdo
authors.initials: GV
authors.lastname: José da Silva
mesh_terms: D000465:Algorithms; D002247:Carbon Isotopes / Q000737:chemistry; D006575:Heterocyclic Compounds, 3-Ring / Q000737:chemistry*; D006859:Hydrogen / Q000737:chemistry; D009682:Magnetic Resonance Spectroscopy / Q000379:methods*; D012997:Solvents / Q000737:chemistry; D013237:Stereoisomerism; D014835:Volatilization
chemical_list: C508290:5-(acetyloxy)-3-hydroxy-9,10-dimethoxy-6-oxo-11-oxatricyclo(6.2.1.0(2,7))undec-2-yl acetate; D002247:Carbon Isotopes; D006575:Heterocyclic Compounds, 3-Ring; D012997:Solvents; D006859:Hydrogen