Chem
J-GLOBAL ID：200907024392290270   Nikkaji number：J1.941.789A

Trifluoromethanesulfonic acid (2aS)-3α,5β-dimethyl-2,2aα,3,4,5,5aβ,6,8aβ-octahydro-1H-pyrrolo[2,1,5-de]quinolizine-7-yl ester

(1S,4S,8S,9R,11R)-9,11-ジメチル-12-アザトリシクロ[6.3.1.04,12]ドデカ-5-エン-6-イル トリフルオロメタンスルホナート
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C14H20F3NO3S
Molecular formula furigana： C14-H20-F3-N-O3-S
Molecular weight： 339.370
InChI： InChI=1S/C14H20F3NO3S/c1-8-5-9(2)13-7-11(21-22(19,20)14(15,16)17)6-10-3-4-12(8)18(10)13/h6,8-10,12-13H,3-5,7H2,1-2H3/t8-,9-,10+,12+,13+/m1/s1
InChI key： ZSGQAEAGYYKDLE-CULRXLKQSA-N
SMILES： C[C@@H]1C[C@@H](C)[C@@H]2CC(=C[C@@H]3CC[C@@H]1N23)OS(=O)(=O)C(F)(F)F
Systematic name  (3)：
  • トリフルオロメタンスルホン酸(2aS)-3α,5β-ジメチル-2,2aα,3,4,5,5aβ,6,8aβ-オクタヒドロ-1H-ピロロ[2,1,5-de]キノリジン-7-イル
  • (1S,4S,8S,9R,11R)-9,11-ジメチル-12-アザトリシクロ[6.3.1.04,12]ドデカ-5-エン-6-イル トリフルオロメタンスルホナート
  • (1S,4S,8S,9R,11R)-9,11-dimethyl-12-azatricyclo[6.3.1.04,12]dodec-5-en-6-yl trifluoromethanesulfonate
Other name (1)：
  • Trifluoromethanesulfonic acid (2aS)-3α,5β-dimethyl-2,2aα,3,4,5,5aβ,6,8aβ-octahydro-1H-pyrrolo[2,1,5-de]quinolizine-7-yl ester
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