Chem
J-GLOBAL ID：200907078389843228   Nikkaji number：J2.172.907H

(5R)-5α,6β-Bis(pivaloyloxy)-2-cyclohexene-1,4-dione

(5R)-5α,6β-ビス(ピバロイルオキシ)-2-シクロヘキセン-1,4-ジオン
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： C16H22O6
Molecular formula furigana： C16-H22-O6
Molecular weight： 310.346
InChI： InChI=1S/C16H22O6/c1-15(2,3)13(19)21-11-9(17)7-8-10(18)12(11)22-14(20)16(4,5)6/h7-8,11-12H,1-6H3/t11-,12-/m0/s1
InChI key： ICPUIYAXFRTISH-RYUDHWBXSA-N
SMILES： CC(C)(C)C(=O)O[C@@H]1[C@@H](OC(=O)C(C)(C)C)C(=O)C=CC1=O
Systematic name  (3)：
  • (5R)-5α,6β-ビス(ピバロイルオキシ)-2-シクロヘキセン-1,4-ジオン
  • (1R,6R)-6-[(2,2-ジメチルプロパノイル)オキシ]-2,5-ジオキソシクロヘキサ-3-エン-1-イル 2,2-ジメチルプロパノアート
  • (1R,6R)-6-[(2,2-dimethylpropanoyl)oxy]-2,5-dioxocyclohex-3-en-1-yl 2,2-dimethylpropanoate
Other name (1)：
  • (5R)-5α,6β-Bis(pivaloyloxy)-2-cyclohexene-1,4-dione
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