Chem
J-GLOBAL ID：200907042617994733
Nikkaji number：J1.239.792E
5-[(1R,6R)-2-Hydroxy-2-methyl-3-oxabicyclo[4.2.0]octane-6-yl]-2-pentanone
5-[(1R,6R)-2-ヒドロキシ-2-メチル-3-オキサビシクロ[4.2.0]オクタン-6-イル]-2-ペンタノン
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： C13H22O3
Molecular formula furigana： C13-H22-O3
Molecular weight： 226.316
InChI：
InChI=1S/C13H22O3/c1-10(14)4-3-6-13-7-5-11(13)12(2,15)16-9-8-13/h11,15H,3-9H2,1-2H3/t11-,12?,13+/m0/s1
InChI key：
UNTFSQJLPQCBDR-IAMFDIQRSA-N
SMILES：
CC(=O)CCC[C@]12CC[C@H]1C(C)(O)OCC2
Systematic name (3)：
- 5-[(1R,6R)-2-ヒドロキシ-2-メチル-3-オキサビシクロ[4.2.0]オクタン-6-イル]-2-ペンタノン
- 5-[(1R,6R)-2-ヒドロキシ-2-メチル-3-オキサビシクロ[4.2.0]オクタン-6-イル]ペンタン-2-オン
- 5-[(1R,6R)-2-hydroxy-2-methyl-3-oxabicyclo[4.2.0]octan-6-yl]pentan-2-one
- 5-[(1R,6R)-2-Hydroxy-2-methyl-3-oxabicyclo[4.2.0]octane-6-yl]-2-pentanone
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