Chem
J-GLOBAL ID：200907029967695805
Nikkaji number：J2.132.102H
(1β,2β,3S,7β,8β)-11,11-Diethylspiro[tricyclo[6.2.1.02,7]undecane-3,2′-oxolane]-9-ene-6-one
(1β,2β,3S,7β,8β)-11,11-ジエチルスピロ[トリシクロ[6.2.1.02,7]ウンデカン-3,2′-オキソラン]-9-エン-6-オン
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
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
Molecular formula： C18H26O2
Molecular formula furigana： C18-H26-O2
Molecular weight： 274.404
InChI：
InChI=1S/C18H26O2/c1-3-17(4-2)12-6-7-13(17)16-15(12)14(19)8-10-18(16)9-5-11-20-18/h6-7,12-13,15-16H,3-5,8-11H2,1-2H3/t12-,13+,15-,16-,18-/m0/s1
InChI key：
XFUVROZFOKYIIS-XIZOUUALSA-N
SMILES：
CCC1(CC)[C@H]2C=C[C@@H]1[C@H]1[C@@H]2C(=O)CC[C@]21CCCO2
Systematic name (3)：
- (1β,2β,3S,7β,8β)-11,11-ジエチルスピロ[トリシクロ[6.2.1.02,7]ウンデカン-3,2′-オキソラン]-9-エン-6-オン
- (1'R,2S,2'S,7'R,8'S)-11',11'-ジエチルスピロ[オキソラン-2,3'-トリシクロ[6.2.1.02,7]ウンデカン]-9'-エン-6'-オン
- (1'R,2S,2'S,7'R,8'S)-11',11'-diethylspiro[oxolane-2,3'-tricyclo[6.2.1.02,7]undecan]-9'-en-6'-one
- (1β,2β,3S,7β,8β)-11,11-Diethylspiro[tricyclo[6.2.1.02,7]undecane-3,2′-oxolane]-9-ene-6-one
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