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SMILES: C(=O)(C=O)c1ccc(cc1)C1CCCCC1.O Canonical SMILES: O=CC(=O)c1ccc(cc1)C1CCCCC1.O InChI: InChI=1S/C14H16O2.H2O/c15-10-14(16)13-8-6-12(7-9-13)11-4-2-1-3-5-11;/h6-11H,1-5H2;1H2 InChIKey: BYPHDBHOPFJXBM-UHFFFAOYSA-N
CBID:66229 http://www.chembase.cn/molecule-66229.html