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(1,1,1-trifluoro-3-oxo-3-phenylpropan-2-yl) benzoate
SpectraBase Compound ID 4sz2ZwbpiRf
InChI InChI=1S/C16H11F3O3/c17-16(18,19)14(13(20)11-7-3-1-4-8-11)22-15(21)12-9-5-2-6-10-12/h1-10,14H
InChIKey LMUWFLJMHATKIP-UHFFFAOYSA-N
Mol Weight 308.26 g/mol
Molecular Formula C16H11F3O3
Exact Mass 308.066029 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K39k7QAUuoF
Name (1,1,1-trifluoro-3-oxo-3-phenylpropan-2-yl) benzoate
Alternate Name(s) (1-benzoyl-2,2,2-trifluoro-ethyl) benzoate benzoic acid (1,1,1-trifluoro-3-oxo-3-phenylpropan-2-yl) ester benzoic acid (1-benzoyl-2,2,2-trifluoro-ethyl) ester
Comments Less than 3 mono-isotopic peaks
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Formula C16H11F3O3
InChI InChI=1S/C16H11F3O3/c17-16(18,19)14(13(20)11-7-3-1-4-8-11)22-15(21)12-9-5-2-6-10-12/h1-10,14H
InChIKey LMUWFLJMHATKIP-UHFFFAOYSA-N
Molecular Weight 308.256 g/mol
SMILES C(C(C(F)(F)F)OC(c1ccccc1)=O)(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-ba171aef567d5a40a0ed
Source of Spectrum E2-48-1342-3
Wiley ID 1555298