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3-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-(acetylamino)benzenesulfonate
SpectraBase Compound ID E3d05jWnqWt
InChI InChI=1S/C18H15N3O5S2/c1-11(22)20-13-5-7-15(8-6-13)28(24,25)26-14-4-2-3-12(9-14)10-16-17(23)21-18(19)27-16/h2-10H,1H3,(H,20,22)(H2,19,21,23)/b16-10-
InChIKey CBGPOSOHJIBVPX-YBEGLDIGSA-N
Mol Weight 417.45 g/mol
Molecular Formula C18H15N3O5S2
Exact Mass 417.045313 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID II4jfTwBqxF
Name 3-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-(acetylamino)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/C18H15N3O5S2/c1-11(22)20-13-5-7-15(8-6-13)28(24,25)26-14-4-2-3-12(9-14)10-16-17(23)21-18(19)27-16/h2-10H,1H3,(H,20,22)(H2,19,21,23)/b16-10-
InChIKey CBGPOSOHJIBVPX-YBEGLDIGSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9037
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: 1001198; UBI_ID: UBI-009040
Synonyms 3-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-(acetylamino)benzenesulfonate
Temperature 313 °C