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SMILES: CCCCC(=C)C=O Canonical SMILES: CCCCC(=C)C=O InChI: InChI=1S/C7H12O/c1-3-4-5-7(2)6-8/h6H,2-5H2,1H3 InChIKey: IWEWQGKFUYQGSN-UHFFFAOYSA-N
CBID:138707 http://www.chembase.cn/molecule-138707.html