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SMILES: c1(ccc(c(c1)C)I)Br Canonical SMILES: Brc1ccc(c(c1)C)I InChI: InChI=1S/C7H6BrI/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3 InChIKey: GHTUADBHTFHMNI-UHFFFAOYSA-N
CBID:6941 http://www.chembase.cn/molecule-6941.html