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SMILES: C1[C@@H]2C[C@@]3(C[C@]1(C[C@@](C3)(C2)Br)C)C Canonical SMILES: C[C@]12C[C@@H]3C[C@@](C1)(C)C[C@](C2)(C3)Br InChI: InChI=1S/C12H19Br/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8H2,1-2H3/t9-,10+,11-,12- InChIKey: QUCXLVDIVQWYJR-CDECOKDKSA-N
CBID:162856 http://www.chembase.cn/molecule-162856.html