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SMILES: C(=O)(C)c1ccc(cc1)CCCCC Canonical SMILES: CCCCCc1ccc(cc1)C(=O)C InChI: InChI=1S/C13H18O/c1-3-4-5-6-12-7-9-13(10-8-12)11(2)14/h7-10H,3-6H2,1-2H3 InChIKey: KBKGPMDADJLBEM-UHFFFAOYSA-N
CBID:70009 http://www.chembase.cn/molecule-70009.html