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SMILES: c1(c(OCC(C)C)ccc(c1)C=O)OCC Canonical SMILES: CCOc1cc(C=O)ccc1OCC(C)C InChI: InChI=1S/C13H18O3/c1-4-15-13-7-11(8-14)5-6-12(13)16-9-10(2)3/h5-8,10H,4,9H2,1-3H3 InChIKey: BVHHJYYHHQIPCB-UHFFFAOYSA-N
CBID:231814 http://www.chembase.cn/molecule-231814.html