Chem
J-GLOBAL ID：200907092658451857   Nikkaji number：J2.754.933K

(3aS,9E)-1-Isopropyl-3aβ,6,10-trimethyl-2,3,3a,4,5,6,7,8,11,12-decahydrocyclopentacycloundecene-6-ylium

(3aS,9E)-1-イソプロピル-3aβ,6,10-トリメチル-2,3,3a,4,5,6,7,8,11,12-デカヒドロシクロペンタシクロウンデセン-6-イリウム
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： C19[C+]H33
Molecular formula furigana： C20-H33
Molecular weight： 273.483
InChI： InChI=1S/C20H33/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,15H,6,8-14H2,1-5H3/q+1/b16-7+/t20-/m0/s1
InChI key： RNMGKOMDOMRXTM-QDGSLSSCSA-N
SMILES： CC(C)C1=C2CC/C(=C/CC[C+](C)CC[C@@]2(C)CC1)/C
Systematic name  (3)：
  • (3aS,9E)-1-イソプロピル-3aβ,6,10-トリメチル-2,3,3a,4,5,6,7,8,11,12-デカヒドロシクロペンタシクロウンデセン-6-イリウム
  • (3aS)-3a,6,10-トリメチル-1-(プロパン-2-イル)-2H,3H,3aH,4H,5H,6H,7H,8H,11H,12H-シクロペンタ[11]アンヌレン-6-イリウム
  • (3aS)-3a,6,10-trimethyl-1-(propan-2-yl)-2H,3H,3aH,4H,5H,6H,7H,8H,11H,12H-cyclopenta[11]annulen-6-ylium
Other name (1)：
  • (3aS,9E)-1-Isopropyl-3aβ,6,10-trimethyl-2,3,3a,4,5,6,7,8,11,12-decahydrocyclopentacycloundecene-6-ylium
Thsaurus map：
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