Chem
J-GLOBAL ID：200907051051100941
Nikkaji number：J1.440.871A
7-Ethynyl-1,3,5-cycloheptatriene
7-エチニル-1,3,5-シクロヘプタトリエン
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： C9H8
Molecular formula furigana： C9-H8
Molecular weight： 116.163
InChI：
InChI=1S/C9H8/c1-2-9-7-5-3-4-6-8-9/h1,3-9H
InChI key：
DICHAIJAQLJTPU-UHFFFAOYSA-N
SMILES：
C#CC1C=CC=CC=C1
Systematic name (3)：
- 7-エチニル-1,3,5-シクロヘプタトリエン
- 7-エチニルシクロヘプタ-1,3,5-トリエン
- 7-ethynylcyclohepta-1,3,5-triene
- 7-Ethynyl-1,3,5-cycloheptatriene
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