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SMILES: C1(C(=O)CCC1=O)Br Canonical SMILES: BrC1C(=O)CCC1=O InChI: InChI=1S/C5H5BrO2/c6-5-3(7)1-2-4(5)8/h5H,1-2H2 InChIKey: ROZCQYLERXSBBC-UHFFFAOYSA-N
CBID:45033 http://www.chembase.cn/molecule-45033.html