Chem
J-GLOBAL ID：200907003384271498   Nikkaji number：J2.080.306A

(E)-4-(2,6,6-Trimethyl-3α-hydroxy-1-cyclohexenyl)-3-butene-2-one

(E)-4-(2,6,6-トリメチル-3α-ヒドロキシ-1-シクロヘキセニル)-3-ブテン-2-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： C13H20O2
Molecular formula furigana： C13-H20-O2
Molecular weight： 208.301
InChI： InChI=1S/C13H20O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-6,12,15H,7-8H2,1-4H3/b6-5+/t12-/m1/s1
InChI key： LICNQDPDQQOXCU-BTDICHCPSA-N
SMILES： CC(=O)/C=C/C1=C(C)[C@H](O)CCC1(C)C
Systematic name  (6)：
  • (3E)-4-[(3R)-2,6,6-トリメチル-3α-ヒドロキシ-1-シクロヘキセニル]-3-ブテン-2-オン
  • (E)-4-[(3R)-3-ヒドロキシ-2,6,6-トリメチル-1-シクロヘキセニル]-3-ブテン-2-オン
  • (E)-4-(3α-ヒドロキシ-2,6,6-トリメチル-1-シクロヘキセニル)-3-ブテン-2-オン
  • (E)-4-(2,6,6-トリメチル-3α-ヒドロキシ-1-シクロヘキセニル)-3-ブテン-2-オン
  • (3E)-4-[(3R)-3-ヒドロキシ-2,6,6-トリメチルシクロヘキサ-1-エン-1-イル]ブタ-3-エン-2-オン
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Other name (4)：
  • (3E)-4-[(3R)-2,6,6-Trimethyl-3α-hydroxy-1-cyclohexenyl]-3-butene-2-one
  • (E)-4-[(3R)-3-Hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-3-butene-2-one
  • (E)-4-(3α-Hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3-butene-2-one
  • (E)-4-(2,6,6-Trimethyl-3α-hydroxy-1-cyclohexenyl)-3-butene-2-one
Thsaurus map：
Thesaurus Map

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