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SMILES: OC(=O)CCCCCC=O Canonical SMILES: O=CCCCCCC(=O)O InChI: InChI=1S/C7H12O3/c8-6-4-2-1-3-5-7(9)10/h6H,1-5H2,(H,9,10) InChIKey: OOFMTFUTWFAVGC-UHFFFAOYSA-N
CBID:111979 http://www.chembase.cn/molecule-111979.html