提示: 按住Ctrl键可以同时选择多个官能团
SMILES: OCCC(C)(O)C Canonical SMILES: OCCC(O)(C)C InChI: InChI=1S/C5H12O2/c1-5(2,7)3-4-6/h6-7H,3-4H2,1-2H3 InChIKey: XPFCZYUVICHKDS-UHFFFAOYSA-N
CBID:77961 http://www.chembase.cn/molecule-77961.html