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SMILES: CCCCCC(CCC)C(=O)O Canonical SMILES: CCCCCC(C(=O)O)CCC InChI: InChI=1S/C10H20O2/c1-3-5-6-8-9(7-4-2)10(11)12/h9H,3-8H2,1-2H3,(H,11,12) InChIKey: RXGPYPPCEXISOV-UHFFFAOYSA-N
CBID:299600 http://www.chembase.cn/molecule-299600.html