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benzoic acid, 4-[[3-[(5Z)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxothiazolidinyl]-1-oxopropyl]amino]-
SpectraBase Compound ID Bw1g9LbgpSX
InChI InChI=1S/C22H20N2O4S2/c1-2-14-3-5-15(6-4-14)13-18-20(26)24(22(29)30-18)12-11-19(25)23-17-9-7-16(8-10-17)21(27)28/h3-10,13H,2,11-12H2,1H3,(H,23,25)(H,27,28)/b18-13-
InChIKey IHFNTDQDXPVXQM-AQTBWJFISA-N
Mol Weight 440.53 g/mol
Molecular Formula C22H20N2O4S2
Exact Mass 440.086449 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 40aGmA5c48d
Name benzoic acid, 4-[[3-[(5Z)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxothiazolidinyl]-1-oxopropyl]amino]-
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/C22H20N2O4S2/c1-2-14-3-5-15(6-4-14)13-18-20(26)24(22(29)30-18)12-11-19(25)23-17-9-7-16(8-10-17)21(27)28/h3-10,13H,2,11-12H2,1H3,(H,23,25)(H,27,28)/b18-13-
InChIKey IHFNTDQDXPVXQM-AQTBWJFISA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_8014
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: NMR/11218017