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Benzoic acid, 4-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]-, methyl ester
SpectraBase Compound ID LXlsIYJAlJd
InChI InChI=1S/C12H9F6NO3/c1-22-10(21)6-2-4-7(5-3-6)19-9(20)8(11(13,14)15)12(16,17)18/h2-5,8H,1H3,(H,19,20)
InChIKey QPEMIYPKGHGGHE-UHFFFAOYSA-N
Mol Weight 329.2 g/mol
Molecular Formula C12H9F6NO3
Exact Mass 329.048662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGbKCoyKpiu
Name Benzoic acid, 4-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]-, methyl ester
Alternate Name(s) 4-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]benzoic acid methyl ester Methyl 4-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]benzoate Methyl 4-[[3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoyl]amino]benzoate
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Formula C12H9F6NO3
InChI InChI=1S/C12H9F6NO3/c1-22-10(21)6-2-4-7(5-3-6)19-9(20)8(11(13,14)15)12(16,17)18/h2-5,8H,1H3,(H,19,20)
InChIKey QPEMIYPKGHGGHE-UHFFFAOYSA-N
Molecular Weight 329.198 g/mol
SMILES N(C(C(C(F)(F)F)C(F)(F)F)=O)c1ccc(cc1)C(OC)=O
SPLASH splash10-02ov-9621000000-4b92bb9c9bd75e7d3e7f
Source of Spectrum IY-2-4802-0
Wiley ID 1656003