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SMILES: c1(OCC(C)C)c(ccc(c1)C=O)OC Canonical SMILES: COc1ccc(cc1OCC(C)C)C=O InChI: InChI=1S/C12H16O3/c1-9(2)8-15-12-6-10(7-13)4-5-11(12)14-3/h4-7,9H,8H2,1-3H3 InChIKey: VUGWJDGEPZNBKZ-UHFFFAOYSA-N
CBID:233288 http://www.chembase.cn/molecule-233288.html