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SMILES: n1cnc(cc1C)CO Canonical SMILES: Cc1cc(CO)ncn1 InChI: InChI=1S/C6H8N2O/c1-5-2-6(3-9)8-4-7-5/h2,4,9H,3H2,1H3 InChIKey: SJMCIDWTRNPZET-UHFFFAOYSA-N
CBID:242771 http://www.chembase.cn/molecule-242771.html