Chem
J-GLOBAL ID:200907050018897790   Nikkaji number:J435.357I

4-[(5S)-2,6,6-Trimethyl-5α-hydroxy-1-cyclohexen-1-yl]-3-buten-2-one

4-[(5S)-2,6,6-トリメチル-5α-ヒドロキシ-1-シクロヘキセン-1-イル]-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/c1-9-5-8-12(15)13(3,4)11(9)7-6-10(2)14/h6-7,12,15H,5,8H2,1-4H3/t12-/m0/s1
InChI key: LXYKLYXWNYMBKQ-LBPRGKRZSA-N
SMILES: CC(=O)C=CC1=C(C)CC[C@H](O)C1(C)C
Systematic name  (3):
  • 4-[(5S)-2,6,6-トリメチル-5α-ヒドロキシ-1-シクロヘキセン-1-イル]-3-ブテン-2-オン
  • 4-[(5S)-5-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
  • 4-[(5S)-5-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]but-3-en-2-one
Other name (1):
  • 4-[(5S)-2,6,6-Trimethyl-5α-hydroxy-1-cyclohexen-1-yl]-3-buten-2-one
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