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SMILES: C1CC(CC1)C(=O)C Canonical SMILES: CC(=O)C1CCCC1 InChI: InChI=1S/C7H12O/c1-6(8)7-4-2-3-5-7/h7H,2-5H2,1H3 InChIKey: LKENTYLPIUIMFG-UHFFFAOYSA-N
CBID:57447 http://www.chembase.cn/molecule-57447.html