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methyl 2-hydroxy-4-oxo-2-(trifluoromethyl)-4-[3-(trifluoromethyl)anilino]butanoate
SpectraBase Compound ID EbG9XEfrhjt
InChI InChI=1S/C13H11F6NO4/c1-24-10(22)11(23,13(17,18)19)6-9(21)20-8-4-2-3-7(5-8)12(14,15)16/h2-5,23H,6H2,1H3,(H,20,21)
InChIKey DFHPCQKBAVUGDF-UHFFFAOYSA-N
Mol Weight 359.22 g/mol
Molecular Formula C13H11F6NO4
Exact Mass 359.059227 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Xm9czDAxoi
Name methyl 2-hydroxy-4-oxo-2-(trifluoromethyl)-4-[3-(trifluoromethyl)anilino]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/C13H11F6NO4/c1-24-10(22)11(23,13(17,18)19)6-9(21)20-8-4-2-3-7(5-8)12(14,15)16/h2-5,23H,6H2,1H3,(H,20,21)
InChIKey DFHPCQKBAVUGDF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1321
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: 9248080; UBI_ID: UBI-001322
Temperature 318 °C