Chem
J-GLOBAL ID：200907041078177185
Nikkaji number：J2.132.103F
(1β,2β,3S,7β,8β)-Spiro[tricyclo[6.2.1.02,7]undecane-3,2′-oxetane]-9-ene-6-one
(1β,2β,3S,7β,8β)-スピロ[トリシクロ[6.2.1.02,7]ウンデカン-3,2′-オキセタン]-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： C13H16O2
Molecular formula furigana： C13-H16-O2
Molecular weight： 204.269
InChI：
InChI=1S/C13H16O2/c14-10-3-4-13(5-6-15-13)12-9-2-1-8(7-9)11(10)12/h1-2,8-9,11-12H,3-7H2/t8-,9+,11+,12+,13+/m1/s1
InChI key：
KEWUGGUXFVJWOZ-RDIPFHLNSA-N
SMILES：
O=C1CC[C@]2(CCO2)[C@H]2[C@@H]3C[C@@H](C=C3)[C@@H]12
Systematic name (3)：
- (1β,2β,3S,7β,8β)-スピロ[トリシクロ[6.2.1.02,7]ウンデカン-3,2′-オキセタン]-9-エン-6-オン
- (1'R,2S,2'S,7'R,8'S)-スピロ[オキセタン-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)-spiro[oxetane-2,3'-tricyclo[6.2.1.02,7]undecan]-9'-en-6'-one
- (1β,2β,3S,7β,8β)-Spiro[tricyclo[6.2.1.02,7]undecane-3,2′-oxetane]-9-ene-6-one
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