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

View entire compound with spectra: 1 NMR

methyl 3-chloro-2-hydroxy-4-oxo-4-(4-toluidino)-2-(trifluoromethyl)butanoate
SpectraBase Compound ID 7akCftN0uL7
InChI InChI=1S/C13H13ClF3NO4/c1-7-3-5-8(6-4-7)18-10(19)9(14)12(21,11(20)22-2)13(15,16)17/h3-6,9,21H,1-2H3,(H,18,19)
InChIKey DNNJZPZUNRYWFG-UHFFFAOYSA-N
Mol Weight 339.7 g/mol
Molecular Formula C13H13ClF3NO4
Exact Mass 339.04852 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2K07ED5wOXv
Name methyl 3-chloro-2-hydroxy-4-oxo-4-(4-toluidino)-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/C13H13ClF3NO4/c1-7-3-5-8(6-4-7)18-10(19)9(14)12(21,11(20)22-2)13(15,16)17/h3-6,9,21H,1-2H3,(H,18,19)
InChIKey DNNJZPZUNRYWFG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12799
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/9313366; UBI_ID: UBI-012802
Temperature 308 °C