Chem
J-GLOBAL ID：200907082155705660
Nikkaji number：J2.047.944B
(2E)-1-[(1R)-1,2,2-Trimethyl-4α-hydroxycyclopentane-1β-yl]-2-pentene-1,4-dione
(2E)-1-[(1R,4S)-4-ヒドロキシ-1,2,2-トリメチルシクロペンチル]ペンタ-2-エン-1,4-ジオン
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： C13H20O3
Molecular formula furigana： C13-H20-O3
Molecular weight： 224.300
InChI：
InChI=1S/C13H20O3/c1-9(14)5-6-11(16)13(4)8-10(15)7-12(13,2)3/h5-6,10,15H,7-8H2,1-4H3/b6-5+/t10-,13-/m0/s1
InChI key：
UQAVZDROKSODIJ-BXQPDHIASA-N
SMILES：
CC(=O)/C=C/C(=O)[C@]1(C)C[C@@H](O)CC1(C)C
Systematic name (3)：
- (2E)-1-[(1R)-1,2,2-トリメチル-4α-ヒドロキシシクロペンタン-1β-イル]-2-ペンテン-1,4-ジオン
- (2E)-1-[(1R,4S)-4-ヒドロキシ-1,2,2-トリメチルシクロペンチル]ペンタ-2-エン-1,4-ジオン
- (2E)-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]pent-2-ene-1,4-dione
- (2E)-1-[(1R)-1,2,2-Trimethyl-4α-hydroxycyclopentane-1β-yl]-2-pentene-1,4-dione
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