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SMILES: c1(C(=O)O)ccc(cc1)CCBr Canonical SMILES: BrCCc1ccc(cc1)C(=O)O InChI: InChI=1S/C9H9BrO2/c10-6-5-7-1-3-8(4-2-7)9(11)12/h1-4H,5-6H2,(H,11,12) InChIKey: BKMRWJWLBHHGCF-UHFFFAOYSA-N
CBID:796873 http://www.chembase.cn/molecule-796873.html