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SMILES: C(=O)(O)COCCCC Canonical SMILES: CCCCOCC(=O)O InChI: InChI=1S/C6H12O3/c1-2-3-4-9-5-6(7)8/h2-5H2,1H3,(H,7,8) InChIKey: AJQOASGWDCBKCJ-UHFFFAOYSA-N
CBID:276680 http://www.chembase.cn/molecule-276680.html