| SpectraBase Compound ID | 9NC7Yh3Jyxd |
|---|---|
| InChI | InChI=1S/C21H17NO2S/c23-19(16-10-4-1-5-11-16)20(25-18-14-8-3-9-15-18)21(24)22-17-12-6-2-7-13-17/h1-15,20H,(H,22,24) |
| InChIKey | VCAFXMSOZNFNKW-UHFFFAOYSA-N |
| Mol Weight | 347.43 g/mol |
| Molecular Formula | C21H17NO2S |
| Exact Mass | 347.098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | PP0rZsRQfQ |
|---|---|
| Name | 2-Benzoyl-2-(phenylthio)acetanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.097999963 u |
| Formula | C21H17NO2S |
| InChI | InChI=1S/C21H17NO2S/c23-19(16-10-4-1-5-11-16)20(25-18-14-8-3-9-15-18)21(24)22-17-12-6-2-7-13-17/h1-15,20H,(H,22,24) |
| InChIKey | VCAFXMSOZNFNKW-UHFFFAOYSA-N |
| Molecular Weight | 347.432 g/mol |
| SMILES | N(C1=CC=CC=C1)C(C(C(C=1C=CC=CC1)=O)SC=1C=CC=CC1)=O |