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4,4-Difluoro-4-benzoylbutyric Acid

View entire compound with spectra: 1 MS (GC)

4,4-Difluoro-4-benzoylbutyric Acid
SpectraBase Compound ID 9vAcMqNSuVS
InChI InChI=1S/C11H10F2O3/c12-11(13,7-6-9(14)15)10(16)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,14,15)
InChIKey KSJJQFQFLAIHMN-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 BrSvglnQ4s4
Name 4,4-Difluoro-4-benzoylbutyric Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10F2O3
InChI InChI=1S/C11H10F2O3/c12-11(13,7-6-9(14)15)10(16)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,14,15)
InChIKey KSJJQFQFLAIHMN-UHFFFAOYSA-N
Molecular Weight 228.195 g/mol
SMILES OC(CCC(C(=O)c1ccccc1)(F)F)=O
SPLASH splash10-0pfr-9500000000-cbc1c0c5c43c2e23c8b3
Source of Spectrum J-60-6804-8
Synonyms 4,4-Difluoro-5-oxo-5-phenylpentanoic acid
Wiley ID 1229322