Chem
J-GLOBAL ID:200907000252366954
Nikkaji number:J2.230.641C
3aα-Methyl-2,3,3a,3bα,4,5,6,7,7aβ,7bα-decahydro-1H-cyclopenta[3,4]cyclobuta[1,2]benzene-1-one
(1S,2R,6S,7S)-6-メチルトリシクロ[5.4.0.02,6 ]ウンデカン-3-オン
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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:
C12 H18 O
Molecular formula furigana:
C12-H18-O
Molecular weight:
178.275
InChI:
InChI=1S/C12H18O/c1-12-7-6-10(13)11(12)8-4-2-3-5-9(8)12/h8-9,11H,2-7H2,1H3/t8-,9-,11-,12-/m0/s1
InChI key:
LCGJGYSHVWVRIG-QSFUFRPTSA-N
SMILES:
C[C@@]12CCC(=O)[C@@H]1[C@H]1CCCC[C@H]21
Systematic name (3):
3aα-メチル-2,3,3a,3bα,4,5,6,7,7aβ,7bα-デカヒドロ-1H-シクロペンタ[3,4]シクロブタ[1,2]ベンゼン-1-オン
(1S,2R,6S,7S)-6-メチルトリシクロ[5.4.0.02,6 ]ウンデカン-3-オン
(1S,2R,6S,7S)-6-methyltricyclo[5.4.0.02,6 ]undecan-3-one
Other name (1):
3aα-Methyl-2,3,3a,3bα,4,5,6,7,7aβ,7bα-decahydro-1H-cyclopenta[3,4]cyclobuta[1,2]benzene-1-one
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