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- W1980809520 abstract "A detailed analysis with total assignment of 1H and 13C NMR spectral data for a cycloheptenone derivative, a key intermediate for the synthesis of perhydroazulene terpenoids, is related. These assignments are based on 1D 1H and 13C NMR and on 2D NMR techniques including gCOSY, gHSQC, gHMBC, J-resolved and NOEDIF experiments. The unequivocal assignments were supported by theoretical chemical shifts and scalar coupling constant calculations at GIAO B3LYP/cc-pVDZ level from optimized structures at the same level of theory." @default.
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- W1980809520 date "2006-03-01" @default.
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- W1980809520 title "Analysis of a cycloheptenone derivative: An experimental and theoretical approach" @default.
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