Chem
J-GLOBAL ID:200907032223854531   Nikkaji number:J2.603.986J

1-Oxylato-2-(trifluoroacetyl)-3α,6α-isopropylidene-6-methylcyclohexene

1-オキシラト-2-(トリフルオロアセチル)-3α,6α-イソプロピリデン-6-メチルシクロヘキセン
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: C12H14F3O[O-]
Molecular formula furigana: C12-H14-F3-O2
Molecular weight: 247.238
InChI: InChI=1S/C12H15F3O2/c1-10(2)6-4-5-11(10,3)8(16)7(6)9(17)12(13,14)15/h6,16H,4-5H2,1-3H3/p-1/t6-,11+/m1/s1
InChI key: FKZUICYBMPLZCI-KBUNVGBDSA-M
SMILES: CC1(C)[C@@H]2CC[C@@]1(C)C(=C2C(=O)C(F)(F)F)[O-]
Systematic name  (4):
  • 1-オキシラト-2-(トリフルオロアセチル)-3α,6α-イソプロピリデン-6-メチルシクロヘキセン
  • (4α)-1β,7,7-トリメチル-2-オキシラト-3-(トリフルオロアセチル)ビシクロ[2.2.1]ヘプタ-2-エン
  • (1R,4S)-1,7,7-トリメチル-3-(2,2,2-トリフルオロアセチル)ビシクロ[2.2.1]ヘプタ-2-エン-2-オラート
  • (1R,4S)-1,7,7-trimethyl-3-(2,2,2-trifluoroacetyl)bicyclo[2.2.1]hept-2-en-2-olate
Other name (2):
  • 1-Oxylato-2-(trifluoroacetyl)-3α,6α-isopropylidene-6-methylcyclohexene
  • (4α)-1β,7,7-Trimethyl-2-oxylato-3-(trifluoroacetyl)bicyclo[2.2.1]hepta-2-ene
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