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((5Z)-5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)acetic acid
SpectraBase Compound ID 8jZvi9eZdp2
InChI InChI=1S/C20H16ClNO5S2/c1-26-16-8-13(9-17-19(25)22(10-18(23)24)20(28)29-17)4-7-15(16)27-11-12-2-5-14(21)6-3-12/h2-9H,10-11H2,1H3,(H,23,24)/b17-9-
InChIKey HUDLKZVIIXLCKO-MFOYZWKCSA-N
Mol Weight 449.92 g/mol
Molecular Formula C20H16ClNO5S2
Exact Mass 449.015843 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IuZHoKLAnbu
Name ((5Z)-5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)acetic 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/C20H16ClNO5S2/c1-26-16-8-13(9-17-19(25)22(10-18(23)24)20(28)29-17)4-7-15(16)27-11-12-2-5-14(21)6-3-12/h2-9H,10-11H2,1H3,(H,23,24)/b17-9-
InChIKey HUDLKZVIIXLCKO-MFOYZWKCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4700
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/6221575; Labnumber: BM-0122504F; UZI_ID: UZI-004702
Synonyms (5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)acetic acid
Temperature 318 °C