Chem
J-GLOBAL ID:200907004445756046   Nikkaji number:J2.267.481A

1-Phenyl-2-(3-methylbutanoyl)-6-heptyne-1-one

1-フェニル-2-(3-メチルブタノイル)-6-ヘプチン-1-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: C18H22O2
Molecular formula furigana: C18-H22-O2
Molecular weight: 270.372
InChI: InChI=1S/C18H22O2/c1-4-5-7-12-16(17(19)13-14(2)3)18(20)15-10-8-6-9-11-15/h1,6,8-11,14,16H,5,7,12-13H2,2-3H3
InChI key: YXIYJKVVDTVICM-UHFFFAOYSA-N
SMILES: CC(C)CC(=O)C(CCCC#C)C(=O)c1ccccc1
Systematic name  (3):
  • 1-フェニル-2-(3-メチルブタノイル)-6-ヘプチン-1-オン
  • 5-メチル-2-(ペンタ-4-イン-1-イル)-1-フェニルヘキサン-1,3-ジオン
  • 5-methyl-2-(pent-4-yn-1-yl)-1-phenylhexane-1,3-dione
Other name (1):
  • 1-Phenyl-2-(3-methylbutanoyl)-6-heptyne-1-one
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