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3-[(5Z)-4-oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid
SpectraBase Compound ID BiPxnC3hhqT
InChI InChI=1S/C15H9NO3S3/c17-13-12(8-11-5-2-6-21-11)22-15(20)16(13)10-4-1-3-9(7-10)14(18)19/h1-8H,(H,18,19)/b12-8-
InChIKey ISNNRBPUTBOXIU-WQLSENKSSA-N
Mol Weight 347.42 g/mol
Molecular Formula C15H9NO3S3
Exact Mass 346.974457 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HfqtmePPSqk
Name 3-[(5Z)-4-oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]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/C15H9NO3S3/c17-13-12(8-11-5-2-6-21-11)22-15(20)16(13)10-4-1-3-9(7-10)14(18)19/h1-8H,(H,18,19)/b12-8-
InChIKey ISNNRBPUTBOXIU-WQLSENKSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2134
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: D01682; Labnumber: GORPS-045-4744; SBI_ID: SBI-002136
Synonyms 3-[4-oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid
Temperature 315 °C