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2-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid
SpectraBase Compound ID 8g1nwlTOrX6
InChI InChI=1S/C15H14FNO3S2/c1-2-3-11(14(19)20)17-13(18)12(22-15(17)21)8-9-4-6-10(16)7-5-9/h4-8,11H,2-3H2,1H3,(H,19,20)/b12-8-
InChIKey TWRCCMVAWAFZFA-WQLSENKSSA-N
Mol Weight 339.4 g/mol
Molecular Formula C15H14FNO3S2
Exact Mass 339.039914 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1gFk9IsTBdv
Name 2-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanoic 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/C15H14FNO3S2/c1-2-3-11(14(19)20)17-13(18)12(22-15(17)21)8-9-4-6-10(16)7-5-9/h4-8,11H,2-3H2,1H3,(H,19,20)/b12-8-
InChIKey TWRCCMVAWAFZFA-WQLSENKSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13033
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: D77602; Labnumber: GORPS-009-3777; SBI_ID: SBI-013036
Synonyms 2-[5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid
Temperature 315 °C