Chem
J-GLOBAL ID：200907001986313199   Nikkaji number：J1.143.973J

(5aR,8aS)-5a-Methyl-4,5,5a,6,7,8-hexahydrocyclopenta[c]pentalene-2(1H)-one

(1S,8R)-8-メチルトリシクロ[6.3.0.01,5]ウンデカ-4-エン-3-オン
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： C12H16O
Molecular formula furigana： C12-H16-O
Molecular weight： 176.259
InChI： InChI=1S/C12H16O/c1-11-4-2-5-12(11)8-10(13)7-9(12)3-6-11/h7H,2-6,8H2,1H3/t11-,12-/m1/s1
InChI key： CDLGNFXQFGXCKQ-VXGBXAGGSA-N
SMILES： C[C@]12CCC[C@@]31CC(=O)C=C3CC2
Systematic name  (4)：
  • (5aR,8aS)-5aα-メチル-4,5,5a,6,7,8-ヘキサヒドロシクロペンタ[c]ペンタレン-2(1H)-オン
  • (5aR,8aS)-5a-メチル-4,5,5a,6,7,8-ヘキサヒドロシクロペンタ[c]ペンタレン-2(1H)-オン
  • (1S,8R)-8-メチルトリシクロ[6.3.0.01,5]ウンデカ-4-エン-3-オン
  • (1S,8R)-8-methyltricyclo[6.3.0.01,5]undec-4-en-3-one
Other name (2)：
  • (5aR,8aS)-5aα-Methyl-4,5,5a,6,7,8-hexahydrocyclopenta[c]pentalene-2(1H)-one
  • (5aR,8aS)-5a-Methyl-4,5,5a,6,7,8-hexahydrocyclopenta[c]pentalene-2(1H)-one
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