| SpectraBase Compound ID | GJzcegwah8i |
|---|---|
| InChI | InChI=1S/C9H11NOS/c11-7-6-10-9(12)8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,10,12) |
| InChIKey | SUCDFYMCVUIDHV-UHFFFAOYSA-N |
| Mol Weight | 181.25 g/mol |
| Molecular Formula | C9H11NOS |
| Exact Mass | 181.056135 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 88TuKYLTdWT |
|---|---|
| Name | N-(2-Hydroxyethyl)thiobenzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.056135151 u |
| Formula | C9H11NOS |
| InChI | InChI=1S/C9H11NOS/c11-7-6-10-9(12)8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,10,12) |
| InChIKey | SUCDFYMCVUIDHV-UHFFFAOYSA-N |
| SMILES | N(C(C1=CC=CC=C1)=S)CCO |
| Spectrum/Structure Validation Score (Raman) | 0.98748 |