| SpectraBase Compound ID | JzSO2ieu7PD |
|---|---|
| InChI | InChI=1S/C10H13NOS/c12-8-4-7-11-10(13)9-5-2-1-3-6-9/h1-3,5-6,12H,4,7-8H2,(H,11,13) |
| InChIKey | QYKUTNDBELJCOC-UHFFFAOYSA-N |
| Mol Weight | 195.28 g/mol |
| Molecular Formula | C10H13NOS |
| Exact Mass | 195.071785 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KQtlchRPt0i |
|---|---|
| Name | N-(3-Hydroxypropyl)thiobenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.071785216 u |
| Formula | C10H13NOS |
| InChI | InChI=1S/C10H13NOS/c12-8-4-7-11-10(13)9-5-2-1-3-6-9/h1-3,5-6,12H,4,7-8H2,(H,11,13) |
| InChIKey | QYKUTNDBELJCOC-UHFFFAOYSA-N |
| Molecular Weight | 195.280 g/mol |
| SMILES | C(=S)(C=1C=CC=CC1)NCCCO |