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SMILES: O=C(CC(CC(C)C)C)C Canonical SMILES: CC(CC(CC(=O)C)C)C InChI: InChI=1S/C9H18O/c1-7(2)5-8(3)6-9(4)10/h7-8H,5-6H2,1-4H3 InChIKey: YXFDTUKUWNQPFV-UHFFFAOYSA-N
CBID:248911 http://www.chembase.cn/molecule-248911.html