Chem
J-GLOBAL ID：201407007679870259
Nikkaji number：J3.317.888C
3α-Phenyloxepane-2-one
3α-フェニルオキセパン-2-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： C12H14O2
Molecular formula furigana： C12-H14-O2
Molecular weight： 190.242
InChI：
InChI=1S/C12H14O2/c13-12-11(8-4-5-9-14-12)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2/t11-/m0/s1
InChI key：
CHRZWHKOEQQAPH-NSHDSACASA-N
SMILES：
O=C1OCCCC[C@H]1c1ccccc1
Systematic name (3)：
- 3α-フェニルオキセパン-2-オン
- (3S)-3-フェニルオキセパン-2-オン
- (3S)-3-phenyloxepan-2-one
- 3α-Phenyloxepane-2-one
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