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4-(3,5-difluorophenyl)-4-keto-butyric acid

View entire compound with spectra: 3 NMR, and 1 FTIR

4-(3,5-difluorophenyl)-4-keto-butyric acid
SpectraBase Compound ID KJUJR4UQg0c
InChI InChI=1S/C10H8F2O3/c11-7-3-6(4-8(12)5-7)9(13)1-2-10(14)15/h3-5H,1-2H2,(H,14,15)
InChIKey SSBFKGDYTIRSOC-UHFFFAOYSA-N
Mol Weight 214.17 g/mol
Molecular Formula C10H8F2O3
Exact Mass 214.04415 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J7ujeSSoIZB
Name 4-(3,5-Difluorophenyl)-4-oxobutyric acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 514683
CAS Registry Number 302912-30-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8F2O3
InChI InChI=1S/C10H8F2O3/c11-7-3-6(4-8(12)5-7)9(13)1-2-10(14)15/h3-5H,1-2H2,(H,14,15)
InChIKey SSBFKGDYTIRSOC-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_010357