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2-chloro-4-{5-[(E)-(2-(4-morpholinyl)-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-furyl}benzoic acid
SpectraBase Compound ID D7vTqhUjoRn
InChI InChI=1S/C19H15ClN2O5S/c20-14-9-11(1-3-13(14)18(24)25)15-4-2-12(27-15)10-16-17(23)21-19(28-16)22-5-7-26-8-6-22/h1-4,9-10H,5-8H2,(H,24,25)/b16-10+
InChIKey XKRNDTWQJCCKTO-MHWRWJLKSA-N
Mol Weight 418.85 g/mol
Molecular Formula C19H15ClN2O5S
Exact Mass 418.03902 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DgDtWq06toa
Name 2-chloro-4-{5-[(E)-(2-(4-morpholinyl)-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-furyl}benzoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H15ClN2O5S/c20-14-9-11(1-3-13(14)18(24)25)15-4-2-12(27-15)10-16-17(23)21-19(28-16)22-5-7-26-8-6-22/h1-4,9-10H,5-8H2,(H,24,25)/b16-10+
InChIKey XKRNDTWQJCCKTO-MHWRWJLKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9324
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: D53485; Labnumber: SPZAM-8067; SBI_ID: SBI-009327
Synonyms 2-chloro-4-{5-[(2-(4-morpholinyl)-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-furyl}benzoic acid
Temperature 308 °C