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2-[(Z)-(4-oxo-2-(1-pyrrolidinyl)-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzenesulfonate
SpectraBase Compound ID Icf2thV0xD7
InChI InChI=1S/C20H18N2O4S2/c23-19-18(27-20(21-19)22-12-6-7-13-22)14-15-8-4-5-11-17(15)26-28(24,25)16-9-2-1-3-10-16/h1-5,8-11,14H,6-7,12-13H2/b18-14-
InChIKey FWWGNALZFIKESZ-JXAWBTAJSA-N
Mol Weight 414.49 g/mol
Molecular Formula C20H18N2O4S2
Exact Mass 414.070799 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HZyyBVPIGWQ
Name 2-[(Z)-(4-oxo-2-(1-pyrrolidinyl)-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzenesulfonate
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/C20H18N2O4S2/c23-19-18(27-20(21-19)22-12-6-7-13-22)14-15-8-4-5-11-17(15)26-28(24,25)16-9-2-1-3-10-16/h1-5,8-11,14H,6-7,12-13H2/b18-14-
InChIKey FWWGNALZFIKESZ-JXAWBTAJSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7210
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: D28482; Labnumber: VLMK0010; SBI_ID: SBI-007213
Synonyms 2-[(4-oxo-2-(1-pyrrolidinyl)-1,3-thiazol-5(4H)-ylidene)methyl]phenyl benzenesulfonate
Temperature 315 °C