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SMILES: O(c1c(ccc(c1C)B(O)O)C)C Canonical SMILES: COc1c(C)ccc(c1C)B(O)O InChI: InChI=1S/C9H13BO3/c1-6-4-5-8(10(11)12)7(2)9(6)13-3/h4-5,11-12H,1-3H3 InChIKey: CWWBCRWPSXQKDK-UHFFFAOYSA-N
CBID:77148 http://www.chembase.cn/molecule-77148.html