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3-thiazolidinehexanoic acid, 5-[(4-fluorophenyl)methylene]-4-oxo-2-thioxo-, (5E)-
SpectraBase Compound ID 2a3yf6uCsXZ
InChI InChI=1S/C16H16FNO3S2/c17-12-7-5-11(6-8-12)10-13-15(21)18(16(22)23-13)9-3-1-2-4-14(19)20/h5-8,10H,1-4,9H2,(H,19,20)/b13-10+
InChIKey CSIAIHVXCOTWLB-JLHYYAGUSA-N
Mol Weight 353.43 g/mol
Molecular Formula C16H16FNO3S2
Exact Mass 353.055564 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3apPS6sNPC
Name 3-thiazolidinehexanoic acid, 5-[(4-fluorophenyl)methylene]-4-oxo-2-thioxo-, (5E)-
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/C16H16FNO3S2/c17-12-7-5-11(6-8-12)10-13-15(21)18(16(22)23-13)9-3-1-2-4-14(19)20/h5-8,10H,1-4,9H2,(H,19,20)/b13-10+
InChIKey CSIAIHVXCOTWLB-JLHYYAGUSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3346
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: NMR/10238319