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3-(3,4,5-Trimethoxyphenyl)rhodanine

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 1 UV-Vis

3-(3,4,5-Trimethoxyphenyl)rhodanine
SpectraBase Compound ID HtBX6Oz9RHN
InChI InChI=1S/C12H13NO4S2/c1-15-8-4-7(5-9(16-2)11(8)17-3)13-10(14)6-19-12(13)18/h4-5H,6H2,1-3H3
InChIKey JOYZMTXOFAFVJF-UHFFFAOYSA-N
Mol Weight 299.36 g/mol
Molecular Formula C12H13NO4S2
Exact Mass 299.0286 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FyQN7rZUptn
Name 3-(3,4,5-Trimethoxyphenyl)rhodanine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.028600247 u
Formula C12H13NO4S2
InChI InChI=1S/C12H13NO4S2/c1-15-8-4-7(5-9(16-2)11(8)17-3)13-10(14)6-19-12(13)18/h4-5H,6H2,1-3H3
InChIKey JOYZMTXOFAFVJF-UHFFFAOYSA-N
Molecular Weight 299.359 g/mol
SMILES C=1C(=C(C(=CC1N1C(SCC1=O)=S)OC)OC)OC
Spectrum/Structure Validation Score (Raman) 0.946909