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SMILES: O=C1C(=O)C(C)CC1.O Canonical SMILES: CC1CCC(=O)C1=O.O InChI: InChI=1S/C6H8O2.H2O/c1-4-2-3-5(7)6(4)8;/h4H,2-3H2,1H3;1H2 InChIKey: LDLRTLHIDXJSQW-UHFFFAOYSA-N
CBID:293048 http://www.chembase.cn/molecule-293048.html