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SMILES: C(=O)(C(CC)CCCCC)O Canonical SMILES: CCCCCC(C(=O)O)CC InChI: InChI=1S/C9H18O2/c1-3-5-6-7-8(4-2)9(10)11/h8H,3-7H2,1-2H3,(H,10,11) InChIKey: DYWSVUBJGFTOQC-UHFFFAOYSA-N
CBID:247112 http://www.chembase.cn/molecule-247112.html