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SMILES: C(=O)(C(Oc1ccc(Br)cc1)C)O Canonical SMILES: CC(C(=O)O)Oc1ccc(cc1)Br InChI: InChI=1S/C9H9BrO3/c1-6(9(11)12)13-8-4-2-7(10)3-5-8/h2-6H,1H3,(H,11,12) InChIKey: IWXNSVLXICBLHY-UHFFFAOYSA-N
CBID:25675 http://www.chembase.cn/molecule-25675.html