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SMILES: C1=C(CCC1=O)O Canonical SMILES: OC1=CC(=O)CC1 InChI: InChI=1S/C5H6O2/c6-4-1-2-5(7)3-4/h3,6H,1-2H2 InChIKey: GGWUYXFIBJPQCE-UHFFFAOYSA-N
CBID:37160 http://www.chembase.cn/molecule-37160.html