Chem
J-GLOBAL ID:200907005613329961   Nikkaji number:J21.215F

Encecaline

エンセカリン
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: C14H16O3
Molecular formula furigana: C14-H16-O3
Molecular weight: 232.279
InChI: InChI=1S/C14H16O3/c1-9(15)11-7-10-5-6-14(2,3)17-12(10)8-13(11)16-4/h5-8H,1-4H3
InChI key: WXVLCNREBFDEKS-UHFFFAOYSA-N
SMILES: COc1cc2OC(C)(C)C=Cc2cc1C(=O)C
Systematic name  (5):
  • 6-(1-オキソエチル)-7-メトキシ-2,2-ジメチル-2H-1-ベンゾピラン
  • 1-(7-メトキシ-2,2-ジメチル-2H-1-ベンゾピラン-6-イル)エタノン
  • 6-アセチル-7-メトキシ-2,2-ジメチル-2H-1-ベンゾピラン
  • 1-(7-メトキシ-2,2-ジメチル-2H-クロメン-6-イル)エタン-1-オン
  • 1-(7-methoxy-2,2-dimethyl-2H-chromen-6-yl)ethan-1-one
Other name (5):
  • エンセカリン
  • Encecalin
  • 1-(7-Methoxy-2,2-dimethyl-2H-1-benzopyran-6-yl)ethanone
  • Encecaline
  • 6-Acetyl-7-methoxy-2,2-dimethyl-2H-1-benzopyran
CAS registry number: 20628-09-5
KEGG COMPOUND: C09005
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