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3-acetyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid
SpectraBase Compound ID Etehn4wMCEY
InChI InChI=1S/C13H12F3NO3S/c1-7(18)17-10(12(19)20)6-21-11(17)8-2-4-9(5-3-8)13(14,15)16/h2-5,10-11H,6H2,1H3,(H,19,20)
InChIKey DKYFIMSRVYKJDE-UHFFFAOYSA-N
Mol Weight 319.3 g/mol
Molecular Formula C13H12F3NO3S
Exact Mass 319.048999 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lo2WkxQvysG
Name 3-acetyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid
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/C13H12F3NO3S/c1-7(18)17-10(12(19)20)6-21-11(17)8-2-4-9(5-3-8)13(14,15)16/h2-5,10-11H,6H2,1H3,(H,19,20)
InChIKey DKYFIMSRVYKJDE-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17876
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/9077734; UBI_ID: UBI-017879
Temperature 308 °C