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SMILES: O=C(CCCC)CCCC Canonical SMILES: CCCCC(=O)CCCC InChI: InChI=1S/C9H18O/c1-3-5-7-9(10)8-6-4-2/h3-8H2,1-2H3 InChIKey: WSGCRAOTEDLMFQ-UHFFFAOYSA-N
CBID:74441 http://www.chembase.cn/molecule-74441.html