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SMILES: c1(cc(C(C)(C)C)ccc1OCC)C=O Canonical SMILES: CCOc1ccc(cc1C=O)C(C)(C)C InChI: InChI=1S/C13H18O2/c1-5-15-12-7-6-11(13(2,3)4)8-10(12)9-14/h6-9H,5H2,1-4H3 InChIKey: GTGVFOSPXJNMIQ-UHFFFAOYSA-N
CBID:50126 http://www.chembase.cn/molecule-50126.html