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SMILES: C(CCC#N)CCBr Canonical SMILES: BrCCCCCC#N InChI: InChI=1S/C6H10BrN/c7-5-3-1-2-4-6-8/h1-5H2 InChIKey: PHOSWLARCIBBJZ-UHFFFAOYSA-N
CBID:110268 http://www.chembase.cn/molecule-110268.html