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SMILES: C#CC(C)C(=O)OC Canonical SMILES: CC(C(=O)OC)C#C InChI: InChI=1S/C6H8O2/c1-4-5(2)6(7)8-3/h1,5H,2-3H3 InChIKey: IXLXCUWRPMTLOH-UHFFFAOYSA-N
CBID:287331 http://www.chembase.cn/molecule-287331.html