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Ethyl (pentafluorobenzoyl)acetate

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

Ethyl (pentafluorobenzoyl)acetate
SpectraBase Compound ID 5xOBUIwgEEX
InChI InChI=1S/C11H7F5O3/c1-2-19-5(18)3-4(17)6-7(12)9(14)11(16)10(15)8(6)13/h2-3H2,1H3
InChIKey SFYYMUUQGSQVFT-UHFFFAOYSA-N
Mol Weight 282.17 g/mol
Molecular Formula C11H7F5O3
Exact Mass 282.031535 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2oYlODFO0i6
Name Ethyl (pentafluorobenzoyl)acetate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 414557
CAS Registry Number 3516-87-8
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7F5O3
InChI 1S/C11H7F5O3/c1-2-19-5(18)3-4(17)6-7(12)9(14)11(16)10(15)8(6)13/h2-3H2,1H3
InChIKey SFYYMUUQGSQVFT-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_009168