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3-Benzoyloxy-4,4,4-trifluoro-1-phenyl-2-butanone
SpectraBase Compound ID CEQgRjuczHr
InChI InChI=1S/C17H13F3O3/c18-17(19,20)15(14(21)11-12-7-3-1-4-8-12)23-16(22)13-9-5-2-6-10-13/h1-10,15H,11H2
InChIKey HFGYTIMJZLXRBB-UHFFFAOYSA-N
Mol Weight 322.28 g/mol
Molecular Formula C17H13F3O3
Exact Mass 322.081679 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8MEqnfFh00a
Name 3-Benzoyloxy-4,4,4-trifluoro-1-phenyl-2-butanone
Alternate Name(s) 2-oxo-3-phenyl-1-(trifluoromethyl)propyl benzoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F3O3
InChI InChI=1S/C17H13F3O3/c18-17(19,20)15(14(21)11-12-7-3-1-4-8-12)23-16(22)13-9-5-2-6-10-13/h1-10,15H,11H2
InChIKey HFGYTIMJZLXRBB-UHFFFAOYSA-N
Molecular Weight 322.283 g/mol
SMILES C(C(F)(F)F)(OC(=O)c1ccccc1)C(Cc1ccccc1)=O
SPLASH splash10-0006-9000000000-319dd8852380e18e5ad9
Source of Spectrum E2-48-1342-3
Wiley ID 1555296