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4-{[(2Z,5Z)-5-(1H-indol-3-ylmethylene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid
SpectraBase Compound ID E4r0X7aeIG
InChI InChI=1S/C20H15N3O3S/c1-23-18(24)17(10-13-11-21-16-5-3-2-4-15(13)16)27-20(23)22-14-8-6-12(7-9-14)19(25)26/h2-11,21H,1H3,(H,25,26)/b17-10-,22-20-
InChIKey SDGIHZCLZRTRKM-UHCDTHPYSA-N
Mol Weight 377.42 g/mol
Molecular Formula C20H15N3O3S
Exact Mass 377.083413 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5T6Tz1xBna4
Name 4-{[(2Z,5Z)-5-(1H-indol-3-ylmethylene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid
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/C20H15N3O3S/c1-23-18(24)17(10-13-11-21-16-5-3-2-4-15(13)16)27-20(23)22-14-8-6-12(7-9-14)19(25)26/h2-11,21H,1H3,(H,25,26)/b17-10-,22-20-
InChIKey SDGIHZCLZRTRKM-UHCDTHPYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1512
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: C96369; Labnumber: SPDEM2-6959; SBI_ID: SBI-001514
Synonyms 4-{[5-(1H-indol-3-ylmethylene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid
Temperature 308 °C