Chem
J-GLOBAL ID：200907027803407199   Nikkaji number：J1.867.311H

4-(2α,4α-Dihydroxy-2,6,6-trimethylcyclohexylidene)-3-butene-2-one

4-(2α,4α-ジヒドロキシ-2,6,6-トリメチルシクロヘキシリデン)-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： C13H20O3
Molecular formula furigana： C13-H20-O3
Molecular weight： 224.300
InChI： InChI=1S/C13H20O3/c1-9(14)5-6-11-12(2,3)7-10(15)8-13(11,4)16/h5,10,15-16H,7-8H2,1-4H3/t6?,10-,13-/m1/s1
InChI key： QMXLZUOHZGYGDY-IFEDUNNLSA-N
SMILES： CC(=O)C=C=C1C(C)(C)C[C@@H](O)C[C@@]1(C)O
Systematic name  (3)：
  • 4-(2α,4α-ジヒドロキシ-2,6,6-トリメチルシクロヘキシリデン)-3-ブテン-2-オン
  • 4-[(2R,4R)-2,4-ジヒドロキシ-2,6,6-トリメチルシクロヘキシリデン]ブタ-3-エン-2-オン
  • 4-[(2R,4R)-2,4-dihydroxy-2,6,6-trimethylcyclohexylidene]but-3-en-2-one
Other name (1)：
  • 4-(2α,4α-Dihydroxy-2,6,6-trimethylcyclohexylidene)-3-butene-2-one
Thsaurus map：
Thesaurus Map

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