Chem
J-GLOBAL ID：200907015229316246   Nikkaji number：J11.525H

1-Phenyl-3-methyl-1-butanone

1-フェニル-3-メチル-1-ブタノン
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： C11H14O
Molecular formula furigana： C11-H14-O
Molecular weight： 162.232
InChI： InChI=1S/C11H14O/c1-9(2)8-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChI key： HEOVGVNITGAUKL-UHFFFAOYSA-N
SMILES： CC(C)CC(=O)c1ccccc1
Systematic name  (9)：
  • β-メチルブチロフェノン
  • β,β-ジメチルプロピオフェノン
  • フェニルイソブチルケトン
  • イソブチルフェニルケトン
  • 1-フェニル-3-メチルブタン-1-オン
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Other name (9)：
  • イソバレロフェノン
  • Isovalerophenone
  • 1-Phenyl-3-methylbutan-1-one
  • 3-Methyl-1-phenyl-1-butanone
  • Isobutyl phenyl ketone
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CAS registry number： 582-62-7
Regulation number (2)：
  • EINECS2094897
  • TSCA(582-62-7)
Thsaurus map：
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