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SMILES: c1c(ccc(c1)Br)CCC=O Canonical SMILES: O=CCCc1ccc(cc1)Br InChI: InChI=1S/C9H9BrO/c10-9-5-3-8(4-6-9)2-1-7-11/h3-7H,1-2H2 InChIKey: RXZJWVPNFPPSEM-UHFFFAOYSA-N
CBID:52983 http://www.chembase.cn/molecule-52983.html