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SMILES: CCCCC(CC)C(C)O Canonical SMILES: CCCCC(C(O)C)CC InChI: InChI=1S/C9H20O/c1-4-6-7-9(5-2)8(3)10/h8-10H,4-7H2,1-3H3 InChIKey: MMQDVLWWGWJSFS-UHFFFAOYSA-N
CBID:109700 http://www.chembase.cn/molecule-109700.html