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SMILES: CC(CCCC(C)(C)O)CC=O Canonical SMILES: O=CCC(CCCC(O)(C)C)C InChI: InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3 InChIKey: WPFVBOQKRVRMJB-UHFFFAOYSA-N
CBID:109019 http://www.chembase.cn/molecule-109019.html