Chem
J-GLOBAL ID:200907016472360721   Nikkaji number:J1.898.061D

(1S,2R)-2,6,6-Trimethylbicyclo[5.4.0]undecane-7-ene-9-one

(1S,2R)-2,6,6-トリメチルビシクロ[5.4.0]ウンデカン-7-エン-9-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: C14H22O
Molecular formula furigana: C14-H22-O
Molecular weight: 206.329
InChI: InChI=1S/C14H22O/c1-10-5-4-8-14(2,3)13-9-11(15)6-7-12(10)13/h9-10,12H,4-8H2,1-3H3/t10-,12+/m1/s1
InChI key: KQRZRDVTZGDBSF-PWSUYJOCSA-N
SMILES: C[C@@H]1CCCC(C)(C)C2=CC(=O)CC[C@@H]12
Systematic name  (4):
  • 5α,9,9-トリメチル-3,4,4aα,5,6,7,8,9-オクタヒドロ-2H-ベンゾシクロヘプテン-2-オン
  • (1S,2R)-2,6,6-トリメチルビシクロ[5.4.0]ウンデカン-7-エン-9-オン
  • (9R,9aS)-5,5,9-トリメチル-2,3,5,6,7,8,9,9a-オクタヒドロ-1H-ベンゾ[7]アンヌレン-3-オン
  • (9R,9aS)-5,5,9-trimethyl-2,3,5,6,7,8,9,9a-octahydro-1H-benzo[7]annulen-3-one
Other name (2):
  • 5α,9,9-Trimethyl-3,4,4aα,5,6,7,8,9-octahydro-2H-benzocycloheptene-2-one
  • (1S,2R)-2,6,6-Trimethylbicyclo[5.4.0]undecane-7-ene-9-one
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