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SMILES: n1(c(ccc1)C=O)C(C)(C)C Canonical SMILES: O=Cc1cccn1C(C)(C)C InChI: InChI=1S/C9H13NO/c1-9(2,3)10-6-4-5-8(10)7-11/h4-7H,1-3H3 InChIKey: VFGRWHIUIWPYOR-UHFFFAOYSA-N
CBID:17568 http://www.chembase.cn/molecule-17568.html