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SMILES: O=C(CC(=O)C)C Canonical SMILES: CC(=O)CC(=O)C InChI: InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3 InChIKey: YRKCREAYFQTBPV-UHFFFAOYSA-N
CBID:77902 http://www.chembase.cn/molecule-77902.html