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SMILES: CCC(C)(O)C#N Canonical SMILES: CC(C#N)(CC)O InChI: InChI=1S/C5H9NO/c1-3-5(2,7)4-6/h7H,3H2,1-2H3 InChIKey: VMEHOTODTPXCKT-UHFFFAOYSA-N
CBID:163148 http://www.chembase.cn/molecule-163148.html