Chem
J-GLOBAL ID:200907092324321294   Nikkaji number:J1.864.928D

2-Methyl-2-[3-(phenylethynyl)-2-cyclohexenyl]-6-benzylidenecyclohexanone

2-メチル-2-[3-(フェニルエチニル)-2-シクロヘキセニル]-6-ベンジリデンシクロヘキサノン
Substance type:
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
Molecular formula: C28H28O
Molecular formula furigana: C28-H28-O
Molecular weight: 380.531
InChI: InChI=1S/C28H28O/c1-28(19-9-15-25(27(28)29)20-23-12-6-3-7-13-23)26-16-8-14-24(21-26)18-17-22-10-4-2-5-11-22/h2-7,10-13,20-21,26H,8-9,14-16,19H2,1H3
InChI key: MQWPKONCPBAJRZ-UHFFFAOYSA-N
SMILES: CC1(CCCC(=Cc2ccccc2)C1=O)C1CCCC(=C1)C#Cc1ccccc1
Systematic name  (3):
  • 2-メチル-2-[3-(フェニルエチニル)-2-シクロヘキセニル]-6-ベンジリデンシクロヘキサノン
  • 2-メチル-2-[3-(2-フェニルエチニル)シクロヘキサ-2-エン-1-イル]-6-(フェニルメチリデン)シクロヘキサン-1-オン
  • 2-methyl-2-[3-(2-phenylethynyl)cyclohex-2-en-1-yl]-6-(phenylmethylidene)cyclohexan-1-one
Other name (1):
  • 2-Methyl-2-[3-(phenylethynyl)-2-cyclohexenyl]-6-benzylidenecyclohexanone
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