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5-(4-Methoxyphenyl)-methylidene-2,4-thiazolidinedione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

5-(4-Methoxyphenyl)-methylidene-2,4-thiazolidinedione
SpectraBase Compound ID CDfnnlYk9sN
InChI InChI=1S/C11H9NO3S/c1-15-8-4-2-7(3-5-8)6-9-10(13)12-11(14)16-9/h2-6H,1H3,(H,12,13,14)/b9-6-
InChIKey VRUKGUBMRBLJJW-TWGQIWQCSA-N
Mol Weight 235.26 g/mol
Molecular Formula C11H9NO3S
Exact Mass 235.030314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I4uFtrDR7Jh
Name 5-(4-Methoxyphenyl)-methylidene-2,4-thiazolidinedione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.030314325 u
Formula C11H9NO3S
InChI InChI=1S/C11H9NO3S/c1-15-8-4-2-7(3-5-8)6-9-10(13)12-11(14)16-9/h2-6H,1H3,(H,12,13,14)/b9-6-
InChIKey VRUKGUBMRBLJJW-TWGQIWQCSA-N
Molecular Weight 235.257 g/mol
SMILES C1(=O)NC(=O)\C(S1)=C\C1=CC=C(C=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945419