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SMILES: N#CCC(C)O Canonical SMILES: CC(CC#N)O InChI: InChI=1S/C4H7NO/c1-4(6)2-3-5/h4,6H,2H2,1H3 InChIKey: BYJAJQGCMSBKPB-UHFFFAOYSA-N
CBID:85474 http://www.chembase.cn/molecule-85474.html