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2-chloro-5-{5-[(E)-(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]-2-furyl}benzoic acid
SpectraBase Compound ID LamH0XlrWJK
InChI InChI=1S/C15H9ClN2O4S/c16-10-3-1-7(5-9(10)14(20)21)12-4-2-8(22-12)6-11-13(19)18-15(23)17-11/h1-6H,(H,20,21)(H2,17,18,19,23)/b11-6+
InChIKey FDQIVTYICYYVOA-IZZDOVSWSA-N
Mol Weight 348.76 g/mol
Molecular Formula C15H9ClN2O4S
Exact Mass 347.997156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6cRHbcTsbcY
Name 2-chloro-5-{5-[(E)-(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]-2-furyl}benzoic 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/C15H9ClN2O4S/c16-10-3-1-7(5-9(10)14(20)21)12-4-2-8(22-12)6-11-13(19)18-15(23)17-11/h1-6H,(H,20,21)(H2,17,18,19,23)/b11-6+
InChIKey FDQIVTYICYYVOA-IZZDOVSWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15649
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/8014778; UBI_ID: UBI-015652
Synonyms 2-chloro-5-{5-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]-2-furyl}benzoic acid
Temperature 318 °C