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SMILES: O.CC(C)(O)C(Cl)(Cl)Cl.CC(C)(O)C(Cl)(Cl)Cl Canonical SMILES: CC(C(Cl)(Cl)Cl)(O)C.CC(C(Cl)(Cl)Cl)(O)C.O InChI: InChI=1S/2C4H7Cl3O.H2O/c2*1-3(2,8)4(5,6)7;/h2*8H,1-2H3;1H2 InChIKey: WRWLCXJYIMRJIN-UHFFFAOYSA-N
CBID:104730 http://www.chembase.cn/molecule-104730.html