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Ethyl 4-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)butanoate
SpectraBase Compound ID CCl0y7X5qbu
InChI InChI=1S/C13H12ClF3O3/c1-2-20-12(19)9(13(15,16)17)7-11(18)8-5-3-4-6-10(8)14/h3-6,9H,2,7H2,1H3
InChIKey UQLMJDXPLHOXPD-UHFFFAOYSA-N
Mol Weight 308.68 g/mol
Molecular Formula C13H12ClF3O3
Exact Mass 308.042706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4NPMWeOu52O
Name Ethyl 4-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClF3O3
InChI InChI=1S/C13H12ClF3O3/c1-2-20-12(19)9(13(15,16)17)7-11(18)8-5-3-4-6-10(8)14/h3-6,9H,2,7H2,1H3
InChIKey UQLMJDXPLHOXPD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201201130
Molecular Weight 308.684 g/mol
SMILES c1cc(C(CC(C(=O)OCC)C(F)(F)F)=O)c(cc1)Cl
SPLASH splash10-002r-3900000000-80c46d953dab5fba7b23
Source of Spectrum CAJ-8-556/SM5-1i
Wiley ID 1771940