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SMILES: CCCC(C)(O)CC Canonical SMILES: CCCC(CC)(O)C InChI: InChI=1S/C7H16O/c1-4-6-7(3,8)5-2/h8H,4-6H2,1-3H3 InChIKey: KYWJZCSJMOILIZ-UHFFFAOYSA-N
CBID:110905 http://www.chembase.cn/molecule-110905.html