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2-[(5Z)-5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid
SpectraBase Compound ID 6wMFXss2x7M
InChI InChI=1S/C16H17NO5S2/c1-3-4-10(15(20)21)17-14(19)13(24-16(17)23)8-9-5-6-11(18)12(7-9)22-2/h5-8,10,18H,3-4H2,1-2H3,(H,20,21)/b13-8-
InChIKey JPXWFFXESCCWTD-JYRVWZFOSA-N
Mol Weight 367.43 g/mol
Molecular Formula C16H17NO5S2
Exact Mass 367.054815 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6RGRx2KnJCK
Name 2-[(5Z)-5-(4-hydroxy-3-methoxybenzylidene)-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/C16H17NO5S2/c1-3-4-10(15(20)21)17-14(19)13(24-16(17)23)8-9-5-6-11(18)12(7-9)22-2/h5-8,10,18H,3-4H2,1-2H3,(H,20,21)/b13-8-
InChIKey JPXWFFXESCCWTD-JYRVWZFOSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13040
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: D77610; Labnumber: GORPS-009-5193; SBI_ID: SBI-013043
Synonyms 2-[5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid
Temperature 315 °C