| SpectraBase Compound ID | 5fBpcHfrE6l |
|---|---|
| InChI | InChI=1S/C9H10N2O2S/c10-6-1-7-14(12,13)9-4-2-8(11)3-5-9/h2-5H,1,7,11H2 |
| InChIKey | FOYCHQIYZYGFJU-UHFFFAOYSA-N |
| Mol Weight | 210.25 g/mol |
| Molecular Formula | C9H10N2O2S |
| Exact Mass | 210.046299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IOFtRh8Oecj |
|---|---|
| Name | 2-Cyanoethyl 4-aminophenyl sulphone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.046298742 u |
| Formula | C9H10N2O2S |
| InChI | InChI=1S/C9H10N2O2S/c10-6-1-7-14(12,13)9-4-2-8(11)3-5-9/h2-5H,1,7,11H2 |
| InChIKey | FOYCHQIYZYGFJU-UHFFFAOYSA-N |
| SMILES | Nc1ccc(cc1)S(=O)(=O)CCC#N |