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SMILES: CCCC1(O)CCCC1 Canonical SMILES: CCCC1(O)CCCC1 InChI: InChI=1S/C8H16O/c1-2-5-8(9)6-3-4-7-8/h9H,2-7H2,1H3 InChIKey: GJEILRJIINEWJO-UHFFFAOYSA-N
CBID:111714 http://www.chembase.cn/molecule-111714.html