![4-Nitro-N-[2-(4-pyridyl)ethyl]benzenesulfonamide](/api/spectrum/E6JM96Lz0Bs/structure.png?h=300&w=458 "4-Nitro-N-[2-(4-pyridyl)ethyl]benzenesulfonamide")
| SpectraBase Compound ID | 441fLVNVRYW |
|---|---|
| InChI | InChI=1S/C13H13N3O4S/c17-16(18)12-1-3-13(4-2-12)21(19,20)15-10-7-11-5-8-14-9-6-11/h1-6,8-9,15H,7,10H2 |
| InChIKey | AYSZLENCZUCTFM-UHFFFAOYSA-N |
| Mol Weight | 307.32 g/mol |
| Molecular Formula | C13H13N3O4S |
| Exact Mass | 307.062677 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E6JM96Lz0Bs |
|---|---|
| Name | 4-Nitro-N-[2-(4-pyridyl)ethyl]benzenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.062677081 u |
| Formula | C13H13N3O4S |
| InChI | InChI=1S/C13H13N3O4S/c17-16(18)12-1-3-13(4-2-12)21(19,20)15-10-7-11-5-8-14-9-6-11/h1-6,8-9,15H,7,10H2 |
| InChIKey | AYSZLENCZUCTFM-UHFFFAOYSA-N |
| Molecular Weight | 307.324 g/mol |
| SMILES | C1=CN=CC=C1CCNS(C=1C=CC(N(=O)=O)=CC1)(=O)=O |