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(2RS,8aRS)-6-Oxo-1,2,3,4,6,7,8,8a-octa-hydro-naphthalene-2-carboxylic acid.

ABSTRACT: The title racemate, C(11)H(14)O(3), aggregates in the crystal structure as acid-to-ketone O-H⋯O hydrogen-bonding catemers whose components are glide-related. The relative stereochemistry at the carboxyl group arises spontaneously during the synthesis. Two inter-molecular C-H⋯O=C close contacts were found, both involving the acid group.

SUBMITTER: Efthimiopoulos G

PROVIDER: S-EPMC2959931 | biostudies-literature | 2008 Nov

REPOSITORIES: biostudies-literature

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(2RS,8aRS)-6-Oxo-1,2,3,4,6,7,8,8a-octa-hydro-naphthalene-2-carboxylic acid.

Efthimiopoulos Georgia G Lalancette Roger A RA Thompson Hugh W HW

Acta crystallographica. Section E, Structure reports online 20081108 Pt 12

The title racemate, C(11)H(14)O(3), aggregates in the crystal structure as acid-to-ketone O-H⋯O hydrogen-bonding catemers whose components are glide-related. The relative stereochemistry at the carboxyl group arises spontaneously during the synthesis. Two inter-molecular C-H⋯O=C close contacts were found, both involving the acid group. ...[more]

PMID: 21581270

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