| SpectraBase Compound ID | 1M5EVXMu7QU |
|---|---|
| InChI | InChI=1S/C15H14N2O2S/c1-11-7-8-15(12(2)9-11)20(18,19)17-10-16-13-5-3-4-6-14(13)17/h3-10H,1-2H3 |
| InChIKey | YMYLBGNWDUXSMG-UHFFFAOYSA-N |
| Mol Weight | 286.35 g/mol |
| Molecular Formula | C15H14N2O2S |
| Exact Mass | 286.077599 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1YfzVQLxvqg |
|---|---|
| Name | 1-(2',4'-Dimethylbenzenesulfonyl)benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.077598871 u |
| Formula | C15H14N2O2S |
| InChI | InChI=1S/C15H14N2O2S/c1-11-7-8-15(12(2)9-11)20(18,19)17-10-16-13-5-3-4-6-14(13)17/h3-10H,1-2H3 |
| InChIKey | YMYLBGNWDUXSMG-UHFFFAOYSA-N |
| Molecular Weight | 286.349 g/mol |
| SMILES | C1=NC=2C(N1S(=O)(=O)C=1C(=CC(=CC1)C)C)=CC=CC2 |