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methyl 3-chloro-4-(2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate

View entire compound with spectra: 1 NMR

methyl 3-chloro-4-(2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
SpectraBase Compound ID JGqXfcsIs8F
InChI InChI=1S/C12H10ClF4NO4/c1-22-10(20)11(21,12(15,16)17)8(13)9(19)18-7-5-3-2-4-6(7)14/h2-5,8,21H,1H3,(H,18,19)
InChIKey YIBQYIZUBCKEAD-UHFFFAOYSA-N
Mol Weight 343.66 g/mol
Molecular Formula C12H10ClF4NO4
Exact Mass 343.023448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DVBF925VcKp
Name methyl 3-chloro-4-(2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H10ClF4NO4/c1-22-10(20)11(21,12(15,16)17)8(13)9(19)18-7-5-3-2-4-6(7)14/h2-5,8,21H,1H3,(H,18,19)
InChIKey YIBQYIZUBCKEAD-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12849
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9315978; UBI_ID: UBI-012852
Temperature 308 °C