Chem
J-GLOBAL ID：200907023275839817   Nikkaji number：J195.265J

3,4-Dimethyl-3-hexen-2-one

3,4-ジメチル-3-ヘキセン-2-オン
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： C8H14O
Molecular formula furigana： C8-H14-O
Molecular weight： 126.199
InChI： InChI=1S/C8H14O/c1-5-6(2)7(3)8(4)9/h5H2,1-4H3
InChI key： WRHRFVOAEDXVPC-UHFFFAOYSA-N
SMILES： CCC(=C(C)C(=O)C)C
Systematic name  (3)：
  • 3,4-ジメチル-3-ヘキセン-2-オン
  • 3,4-ジメチルヘキサ-3-エン-2-オン
  • 3,4-dimethylhex-3-en-2-one
Other name (1)：
  • 3,4-Dimethyl-3-hexen-2-one
CAS registry number： 1635-02-5
Regulation number (1)：
  • EINECS2166568
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