Chem
J-GLOBAL ID：200907093665305196
Nikkaji number：J879.936I
2β-[(E)-1,3-Butadienyl]-3α-(2-propenyl)cyclohexanol
2β-[(E)-1,3-ブタジエニル]-3α-(2-プロペニル)シクロヘキサノール
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： C13H20O
Molecular formula furigana： C13-H20-O
Molecular weight： 192.302
InChI：
InChI=1S/C13H20O/c1-3-5-9-12-11(7-4-2)8-6-10-13(12)14/h3-5,9,11-14H,1-2,6-8,10H2/b9-5+/t11-,12+,13?/m1/s1
InChI key：
IWMXBVSBOPMNRM-FWBIDSOASA-N
SMILES：
OC1CCC[C@@H](CC=C)[C@@H]1/C=C/C=C
Systematic name (3)：
- 2β-[(E)-1,3-ブタジエニル]-3α-(2-プロペニル)シクロヘキサノール
- (2R,3S)-2-[(1E)-ブタ-1,3-ジエン-1-イル]-3-(プロパ-2-エン-1-イル)シクロヘキサン-1-オール
- (2R,3S)-2-[(1E)-buta-1,3-dien-1-yl]-3-(prop-2-en-1-yl)cyclohexan-1-ol
- 2β-[(E)-1,3-Butadienyl]-3α-(2-propenyl)cyclohexanol
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