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5-Piperonylidene-2,4-thiazolidinedione

View entire compound with spectra: 1 NMR, and 1 FTIR

5-Piperonylidene-2,4-thiazolidinedione
SpectraBase Compound ID 2EHy1Y5THl9
InChI InChI=1S/C11H7NO4S/c13-10-9(17-11(14)12-10)4-6-1-2-7-8(3-6)16-5-15-7/h1-4H,5H2,(H,12,13,14)/b9-4-
InChIKey SDGWAUUPHUBJNQ-WTKPLQERSA-N
Mol Weight 249.24 g/mol
Molecular Formula C11H7NO4S
Exact Mass 249.009579 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HYWwuII6cOv
Name 5-Piperonylidene-2,4-thiazolidinedione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.009578879 u
Formula C11H7NO4S
InChI InChI=1S/C11H7NO4S/c13-10-9(17-11(14)12-10)4-6-1-2-7-8(3-6)16-5-15-7/h1-4H,5H2,(H,12,13,14)/b9-4-
InChIKey SDGWAUUPHUBJNQ-WTKPLQERSA-N
Molecular Weight 249.240 g/mol
SMILES C1=C(\C=C\2SC(=O)NC2=O)C=CC2=C1OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9124