Chem
J-GLOBAL ID：200907011221551330   Nikkaji number：J1.465.772J

2β-Iodo-3β-methyl-3-(5-hexynyl)cyclohexanone

2β-ヨード-3β-メチル-3-(5-ヘキシニル)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： C13H19IO
Molecular formula furigana： C13-H19-I-O
Molecular weight： 318.198
InChI： InChI=1S/C13H19IO/c1-3-4-5-6-9-13(2)10-7-8-11(15)12(13)14/h1,12H,4-10H2,2H3/t12-,13-/m1/s1
InChI key： XVGFPLJFSXJRSS-CHWSQXEVSA-N
SMILES： C[C@@]1(CCCCC#C)CCCC(=O)[C@H]1I
Systematic name  (3)：
  • 2β-ヨード-3β-メチル-3-(5-ヘキシニル)シクロヘキサノン
  • (2S,3R)-3-(ヘキサ-5-イン-1-イル)-2-ヨード-3-メチルシクロヘキサン-1-オン
  • (2S,3R)-3-(hex-5-yn-1-yl)-2-iodo-3-methylcyclohexan-1-one
Other name (1)：
  • 2β-Iodo-3β-methyl-3-(5-hexynyl)cyclohexanone
Thsaurus map：
Thesaurus Map

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