Chem
J-GLOBAL ID：201407019220606093   Nikkaji number：J3.276.724I

4-(4,4,9,9-Tetrafluoro-1-oxaspiro[2.6]nonane-5-ylmethyl)benzoic acid methyl ester

4-(4,4,9,9-テトラフルオロ-1-オキサスピロ[2.6]ノナン-5-イルメチル)安息香酸メチル
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： C17H18F4O3
Molecular formula furigana： C17-H18-F4-O3
Molecular weight： 346.322
InChI： InChI=1S/C17H18F4O3/c1-23-14(22)12-6-4-11(5-7-12)9-13-3-2-8-16(18,19)15(10-24-15)17(13,20)21/h4-7,13H,2-3,8-10H2,1H3
InChI key： BICCBMWSTNMMAT-UHFFFAOYSA-N
SMILES： COC(=O)c1ccc(CC2CCCC(F)(F)C3(CO3)C2(F)F)cc1
Systematic name  (3)：
  • 4-(4,4,9,9-テトラフルオロ-1-オキサスピロ[2.6]ノナン-5-イルメチル)安息香酸メチル
  • メチル 4-({4,4,9,9-テトラフルオロ-1-オキサスピロ[2.6]ノナン-5-イル}メチル)ベンゾアート
  • methyl 4-({4,4,9,9-tetrafluoro-1-oxaspiro[2.6]nonan-5-yl}methyl)benzoate
Other name (1)：
  • 4-(4,4,9,9-Tetrafluoro-1-oxaspiro[2.6]nonane-5-ylmethyl)benzoic acid methyl ester
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