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SMILES: c1(cc(oc1C)C(C)C)C(=O)O Canonical SMILES: CC(c1oc(c(c1)C(=O)O)C)C InChI: InChI=1S/C9H12O3/c1-5(2)8-4-7(9(10)11)6(3)12-8/h4-5H,1-3H3,(H,10,11) InChIKey: WQUFPWFQPKBPHQ-UHFFFAOYSA-N
CBID:312495 http://www.chembase.cn/molecule-312495.html