Chem
J-GLOBAL ID：200907038548460325
Nikkaji number：J885.627C
(1β,4β)-7-Oxabicyclo[2.2.1]hepta-2,5-diene
(1β,4β)-7-オキサビシクロ[2.2.1]ヘプタ-2,5-ジエン
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： C6H6O
Molecular formula furigana： C6-H6-O
Molecular weight： 94.113
InChI：
InChI=1S/C6H6O/c1-2-6-4-3-5(1)7-6/h1-6H/t5-,6+
InChI key：
YKCNBNDWSATCJL-OLQVQODUSA-N
SMILES：
O1[C@H]2C=C[C@@H]1C=C2
Systematic name (3)：
- (1β,4β)-7-オキサビシクロ[2.2.1]ヘプタ-2,5-ジエン
- (1s,4s)-7-オキサビシクロ[2.2.1]ヘプタ-2,5-ジエン
- (1s,4s)-7-oxabicyclo[2.2.1]hepta-2,5-diene
- (1β,4β)-7-Oxabicyclo[2.2.1]hepta-2,5-diene
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