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2,2-Difluoro-5-oxo-5-phenylpentanoic acid
SpectraBase Compound ID DSi975GTHLD
InChI InChI=1S/C11H10F2O3/c12-11(13,10(15)16)7-6-9(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16)
InChIKey KXZQAHXCHDEYJC-UHFFFAOYSA-N
Mol Weight 228.19 g/mol
Molecular Formula C11H10F2O3
Exact Mass 228.059801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VrXvGfuPq2
Name 2,2-Difluoro-5-oxo-5-phenylpentanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C11H10F2O3
InChI InChI=1S/C11H10F2O3/c12-11(13,10(15)16)7-6-9(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16)
InChIKey KXZQAHXCHDEYJC-UHFFFAOYSA-N
Molecular Weight 228.195 g/mol
SMILES OC(C(CCC(c1ccccc1)=O)(F)F)=O
SPLASH splash10-004i-9010000000-e2dcbd49da6fcca7ed79
Source of Spectrum F-51-1915-15
Wiley ID 790834