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N-(1,3-benzodioxol-5-yl)-4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
SpectraBase Compound ID 1h1e3Ky9j5t
InChI InChI=1S/C21H17ClN2O4S2/c22-15-5-2-1-4-13(15)10-18-20(26)24(21(29)30-18)9-3-6-19(25)23-14-7-8-16-17(11-14)28-12-27-16/h1-2,4-5,7-8,10-11H,3,6,9,12H2,(H,23,25)/b18-10-
InChIKey RDVOGAOACUZEEK-ZDLGFXPLSA-N
Mol Weight 460.95 g/mol
Molecular Formula C21H17ClN2O4S2
Exact Mass 460.031827 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ge7PBw6SIt
Name N-(1,3-benzodioxol-5-yl)-4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
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/C21H17ClN2O4S2/c22-15-5-2-1-4-13(15)10-18-20(26)24(21(29)30-18)9-3-6-19(25)23-14-7-8-16-17(11-14)28-12-27-16/h1-2,4-5,7-8,10-11H,3,6,9,12H2,(H,23,25)/b18-10-
InChIKey RDVOGAOACUZEEK-ZDLGFXPLSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9733
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: 128443; Labnumber: EX00110787; VK_ID: VK-009737
Synonyms N-(1,3-benzodioxol-5-yl)-4-[5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Temperature 318 °C