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SMILES: COCCC[O-].COCCC[O-].[Ba+2] Canonical SMILES: [O-]CCCOC.[O-]CCCOC.[Ba+2] InChI: InChI=1S/2C4H9O2.Ba/c2*1-6-4-2-3-5;/h2*2-4H2,1H3;/q2*-1;+2 InChIKey: XSLFOJXFFDQWAV-UHFFFAOYSA-N
CBID:303576 http://www.chembase.cn/molecule-303576.html