Chem
J-GLOBAL ID：200907078623525650
Nikkaji number：J2.140.067J
2-Phenyl-3,3-dimethyl-1,4-pentadiene
2-フェニル-3,3-ジメチル-1,4-ペンタジエン
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： C13H16
Molecular formula furigana： C13-H16
Molecular weight： 172.271
InChI：
InChI=1S/C13H16/c1-5-13(3,4)11(2)12-9-7-6-8-10-12/h5-10H,1-2H2,3-4H3
InChI key：
SYWFZHKTGPTRPV-UHFFFAOYSA-N
SMILES：
CC(C)(C=C)C(=C)c1ccccc1
Systematic name (3)：
- 2-フェニル-3,3-ジメチル-1,4-ペンタジエン
- (3,3-ジメチルペンタ-1,4-ジエン-2-イル)ベンゼン
- (3,3-dimethylpenta-1,4-dien-2-yl)benzene
- 2-Phenyl-3,3-dimethyl-1,4-pentadiene
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