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SMILES: C(C=O)(C)(CCC#N)C Canonical SMILES: O=CC(CCC#N)(C)C InChI: InChI=1S/C7H11NO/c1-7(2,6-9)4-3-5-8/h6H,3-4H2,1-2H3 InChIKey: HKJVKIURQSVEQB-UHFFFAOYSA-N
CBID:25260 http://www.chembase.cn/molecule-25260.html