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SMILES: C1CC(=O)c2c(C1(C)C)ccc(c2)Br Canonical SMILES: Brc1ccc2c(c1)C(=O)CCC2(C)C InChI: InChI=1S/C12H13BrO/c1-12(2)6-5-11(14)9-7-8(13)3-4-10(9)12/h3-4,7H,5-6H2,1-2H3 InChIKey: QZSBQGIPLDEDIX-UHFFFAOYSA-N
CBID:162864 http://www.chembase.cn/molecule-162864.html