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SMILES: O1CCC(=CC#N)CC1 Canonical SMILES: N#CC=C1CCOCC1 InChI: InChI=1S/C7H9NO/c8-4-1-7-2-5-9-6-3-7/h1H,2-3,5-6H2 InChIKey: XITDIIYCZBJKTM-UHFFFAOYSA-N
CBID:75664 http://www.chembase.cn/molecule-75664.html