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SMILES: C(C(=O)CC)Br Canonical SMILES: CCC(=O)CBr InChI: InChI=1S/C4H7BrO/c1-2-4(6)3-5/h2-3H2,1H3 InChIKey: CCXQVBSQUQCEEO-UHFFFAOYSA-N
CBID:6798 http://www.chembase.cn/molecule-6798.html