Chem
J-GLOBAL ID：200907093142565895
Nikkaji number：J1.478.064E
2α-Ethynyloxepane-3β-ol acetate
2α-エチニルオキセパン-3β-オールアセタート
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： C10H14O3
Molecular formula furigana： C10-H14-O3
Molecular weight： 182.219
InChI：
InChI=1S/C10H14O3/c1-3-9-10(13-8(2)11)6-4-5-7-12-9/h1,9-10H,4-7H2,2H3/t9-,10+/m1/s1
InChI key：
GXAHHKMBHOORIQ-ZJUUUORDSA-N
SMILES：
CC(=O)O[C@H]1CCCCO[C@@H]1C#C
Systematic name (3)：
- 2α-エチニルオキセパン-3β-オールアセタート
- (2R,3S)-2-エチニルオキセパン-3-イル アセタート
- (2R,3S)-2-ethynyloxepan-3-yl acetate
- 2α-Ethynyloxepane-3β-ol acetate
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