Chem
J-GLOBAL ID:200907001095155819   Nikkaji number:J1.420.038J

1-[[(2S)-2α-(3-Methylphenyl)tetrahydro-2H-pyran]-3α-yl]-2,2,2-trifluoroethanone

2,2,2-トリフルオロ-1-[(2S,3R)-2-(3-メチルフェニル)オキサン-3-イル]エタン-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: C14H15F3O2
Molecular formula furigana: C14-H15-F3-O2
Molecular weight: 272.267
InChI: InChI=1S/C14H15F3O2/c1-9-4-2-5-10(8-9)12-11(6-3-7-19-12)13(18)14(15,16)17/h2,4-5,8,11-12H,3,6-7H2,1H3/t11-,12-/m1/s1
InChI key: MVLQVCSZKLXMBB-VXGBXAGGSA-N
SMILES: Cc1cccc(c1)[C@H]1OCCC[C@H]1C(=O)C(F)(F)F
Systematic name  (3):
  • 1-[[(2S)-2α-(3-メチルフェニル)テトラヒドロ-2H-ピラン]-3α-イル]-2,2,2-トリフルオロエタノン
  • 2,2,2-トリフルオロ-1-[(2S,3R)-2-(3-メチルフェニル)オキサン-3-イル]エタン-1-オン
  • 2,2,2-trifluoro-1-[(2S,3R)-2-(3-methylphenyl)oxan-3-yl]ethan-1-one
Other name (1):
  • 1-[[(2S)-2α-(3-Methylphenyl)tetrahydro-2H-pyran]-3α-yl]-2,2,2-trifluoroethanone
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