Yu-min Liu, He Liu, Yong-qi Hu
Apr 16, 2008
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Journal
Journal of Chemical Crystallography
Abstract
The title compound 3-quinuclidinyl α-(cyclopentyl-1-ene)-α-hydroxy-α-phenylacetate was obtained by the reaction of methyl α-(cyclopentyl-1-ene)-α-hydroxy-α-phenylacetate with 3-quinuclidinol in n-heptane. Its structure was characterized by 1H, 13C NMR, MS and X-ray single-crystal diffraction techniques: C20H25NO3, Mr = 327.41, orthorhombic, space group P212121 with a = 8.547(2), b = 11.428(4), c = 18.288(5) Å, V = 1786.3(9) Å3, Z = 4. The title compound comprises a tertiary α-hydroxy acid and a bicyclo[2.2.2]octan moiety. The crystal structure shows the presence of the intermolecular O(1)–H(1)···N(1) hydrogen bonds.Index AbstractThe title compound, 3-quinuclidinyl α-(cyclopentyl-1-ene)-α-hydroxy-α-phenylacetate was obtained by the reaction of methyl α-(cyclopentyl-1-ene)-α-hydroxy-α-phenylacetate with 3-quinuclidinol in n-heptane and its crystal structure determined. The title compound comprises a tertiary α-hydroxy acid and a bicyclo[2.2.2]octan moiety. The crystal structure shows the presence of the intermolecular O(1)–H(1)···N(1) hydrogen bonds.