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SMILES: n1cn(cc1)CCBr Canonical SMILES: BrCCn1cncc1 InChI: InChI=1S/C5H7BrN2/c6-1-3-8-4-2-7-5-8/h2,4-5H,1,3H2 InChIKey: LKUVBYVPXLUHPM-UHFFFAOYSA-N
CBID:307053 http://www.chembase.cn/molecule-307053.html