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SMILES: O(CC(C)C)C(=O)CC#N Canonical SMILES: N#CCC(=O)OCC(C)C InChI: InChI=1S/C7H11NO2/c1-6(2)5-10-7(9)3-4-8/h6H,3,5H2,1-2H3 InChIKey: HRGQEKKNLHJZGZ-UHFFFAOYSA-N
CBID:85933 http://www.chembase.cn/molecule-85933.html