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SMILES: c1c(ccc(c1)CCC)C(C)C(=O)O Canonical SMILES: CCCc1ccc(cc1)C(C(=O)O)C InChI: InChI=1S/C12H16O2/c1-3-4-10-5-7-11(8-6-10)9(2)12(13)14/h5-9H,3-4H2,1-2H3,(H,13,14) InChIKey: DMJYWNOMDAPUTN-UHFFFAOYSA-N
CBID:173946 http://www.chembase.cn/molecule-173946.html