| SpectraBase Compound ID | LouPYvMZfl4 |
|---|---|
| InChI | InChI=1S/C10H11NO3S/c1-8-2-4-9(5-3-8)11-7-15(13,14)6-10(11)12/h2-5H,6-7H2,1H3 |
| InChIKey | DOVGISHMAAMYST-UHFFFAOYSA-N |
| Mol Weight | 225.26 g/mol |
| Molecular Formula | C10H11NO3S |
| Exact Mass | 225.045964 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1363imboXDN |
|---|---|
| Name | 3-p-Tolyl-4-thiazolidinone, 1,1-dioxide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.045964389 u |
| Formula | C10H11NO3S |
| InChI | InChI=1S/C10H11NO3S/c1-8-2-4-9(5-3-8)11-7-15(13,14)6-10(11)12/h2-5H,6-7H2,1H3 |
| InChIKey | DOVGISHMAAMYST-UHFFFAOYSA-N |
| SMILES | CC1=CC=C(N2C(=O)CS(=O)(=O)C2)C=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.850712 |