| SpectraBase Compound ID | JAtQRA8MjHA |
|---|---|
| InChI | InChI=1S/C11H14BrNO2S/c12-10-4-6-11(7-5-10)16(14,15)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2 |
| InChIKey | AVWJTUSLSQWCFK-UHFFFAOYSA-N |
| Mol Weight | 304.2 g/mol |
| Molecular Formula | C11H14BrNO2S |
| Exact Mass | 302.992863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CqZ5TJR0EfG |
|---|---|
| Name | 1-(p-Bromobenzenesulfonyl)piperidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.992862867 u |
| Formula | C11H14BrNO2S |
| InChI | InChI=1S/C11H14BrNO2S/c12-10-4-6-11(7-5-10)16(14,15)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2 |
| InChIKey | AVWJTUSLSQWCFK-UHFFFAOYSA-N |
| Molecular Weight | 304.202 g/mol |
| SMILES | C1CCN(CC1)S(=O)(=O)C1=CC=C(C=C1)Br |