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SMILES: c1(ccc(cc1)Br)C(O)CCC Canonical SMILES: CCCC(c1ccc(cc1)Br)O InChI: InChI=1S/C10H13BrO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7,10,12H,2-3H2,1H3 InChIKey: DQQQQAUVVHNVPH-UHFFFAOYSA-N
CBID:310563 http://www.chembase.cn/molecule-310563.html