| SpectraBase Compound ID | CYhxuJAQAoC |
|---|---|
| InChI | InChI=1S/C9H11NO3S/c1-14(12,13)7-9(11)10-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,10,11) |
| InChIKey | PRMMHJVZXNSQNA-UHFFFAOYSA-N |
| Mol Weight | 213.25 g/mol |
| Molecular Formula | C9H11NO3S |
| Exact Mass | 213.045964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNudGg0vtWp |
|---|---|
| Name | 2-(Methylsulfonyl)-N-phenylacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.045964389 u |
| Formula | C9H11NO3S |
| InChI | InChI=1S/C9H11NO3S/c1-14(12,13)7-9(11)10-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,10,11) |
| InChIKey | PRMMHJVZXNSQNA-UHFFFAOYSA-N |
| Molecular Weight | 213.251 g/mol |
| SMILES | C(S(=O)(=O)C)C(NC=1C=CC=CC1)=O |