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SMILES: C(=O)(CCOc1ccc(Br)cc1)O Canonical SMILES: OC(=O)CCOc1ccc(cc1)Br InChI: InChI=1S/C9H9BrO3/c10-7-1-3-8(4-2-7)13-6-5-9(11)12/h1-4H,5-6H2,(H,11,12) InChIKey: IGFOICGMVYKSCD-UHFFFAOYSA-N
CBID:256405 http://www.chembase.cn/molecule-256405.html