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SMILES: C(O)c1cnn(c1)C1OCCCC1 Canonical SMILES: OCc1cnn(c1)C1CCCCO1 InChI: InChI=1S/C9H14N2O2/c12-7-8-5-10-11(6-8)9-3-1-2-4-13-9/h5-6,9,12H,1-4,7H2 InChIKey: PBHINQDJZGHENZ-UHFFFAOYSA-N
CBID:796359 http://www.chembase.cn/molecule-796359.html