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SMILES: c1(cccc(c1)C(C=O)C=O)Br Canonical SMILES: O=CC(c1cccc(c1)Br)C=O InChI: InChI=1S/C9H7BrO2/c10-9-3-1-2-7(4-9)8(5-11)6-12/h1-6,8H InChIKey: VTBBNWPPNCLEMB-UHFFFAOYSA-N
CBID:10460 http://www.chembase.cn/molecule-10460.html