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benzoic acid, 4-[(Z)-[3-[2-[[3-(dimethylamino)propyl]amino]-2-oxoethyl]-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-[(Z)-[3-[2-[[3-(dimethylamino)propyl]amino]-2-oxoethyl]-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
SpectraBase Compound ID 9EtdyT2Hsf
InChI InChI=1S/C19H23N3O4S2/c1-21(2)10-4-9-20-16(23)12-22-17(24)15(28-19(22)27)11-13-5-7-14(8-6-13)18(25)26-3/h5-8,11H,4,9-10,12H2,1-3H3,(H,20,23)/b15-11-
InChIKey XTHONEKRVVJYPB-PTNGSMBKSA-N
Mol Weight 421.53 g/mol
Molecular Formula C19H23N3O4S2
Exact Mass 421.112999 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JeySm37B7Nv
Name benzoic acid, 4-[(Z)-[3-[2-[[3-(dimethylamino)propyl]amino]-2-oxoethyl]-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
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/C19H23N3O4S2/c1-21(2)10-4-9-20-16(23)12-22-17(24)15(28-19(22)27)11-13-5-7-14(8-6-13)18(25)26-3/h5-8,11H,4,9-10,12H2,1-3H3,(H,20,23)/b15-11-
InChIKey XTHONEKRVVJYPB-PTNGSMBKSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5508
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: F25830; Labnumber: EXGOR1-10002