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SMILES: CCCC/C=C/C(C)C Canonical SMILES: CCCC/C=C/C(C)C InChI: InChI=1S/C9H18/c1-4-5-6-7-8-9(2)3/h7-9H,4-6H2,1-3H3 InChIKey: RXYSIDRRVRTDIF-UHFFFAOYSA-N
CBID:112673 http://www.chembase.cn/molecule-112673.html