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SMILES: CCC(CC)(CO)CO Canonical SMILES: CCC(CO)(CO)CC InChI: InChI=1S/C7H16O2/c1-3-7(4-2,5-8)6-9/h8-9H,3-6H2,1-2H3 InChIKey: XRVCFZPJAHWYTB-UHFFFAOYSA-N
CBID:108188 http://www.chembase.cn/molecule-108188.html