| SpectraBase Compound ID | 1ohcAVBLfVq |
|---|---|
| InChI | InChI=1S/C10H7NO2S2/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14) |
| InChIKey | RAYIDZVPIAJJPF-UHFFFAOYSA-N |
| Mol Weight | 237.29 g/mol |
| Molecular Formula | C10H7NO2S2 |
| Exact Mass | 236.991821 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1uIeTEMc15C |
|---|---|
| Name | 5-(p-Hydroxybenzylidene)rhodanine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.991820815 u |
| Formula | C10H7NO2S2 |
| InChI | InChI=1S/C10H7NO2S2/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14) |
| InChIKey | RAYIDZVPIAJJPF-UHFFFAOYSA-N |
| SMILES | OC=1C=CC(C=C2SC(NC2=O)=S)=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.933746 |