![1-[(2-Nitrophenyl)sulfonyl]-4-(2-pyridinyl)piperazine](/api/spectrum/7X1E5Ht3oe5/structure.png?h=300&w=458 "1-[(2-Nitrophenyl)sulfonyl]-4-(2-pyridinyl)piperazine")
| SpectraBase Compound ID | 5JWWzpCjWjM |
|---|---|
| InChI | InChI=1S/C15H16N4O4S/c20-19(21)13-5-1-2-6-14(13)24(22,23)18-11-9-17(10-12-18)15-7-3-4-8-16-15/h1-8H,9-12H2 |
| InChIKey | PJFNKTAOOHZYRB-UHFFFAOYSA-N |
| Mol Weight | 348.38 g/mol |
| Molecular Formula | C15H16N4O4S |
| Exact Mass | 348.089226 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7X1E5Ht3oe5 |
|---|---|
| Name | 1-[(2-Nitrophenyl)sulfonyl]-4-(2-pyridinyl)piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.089226181 u |
| Formula | C15H16N4O4S |
| InChI | InChI=1S/C15H16N4O4S/c20-19(21)13-5-1-2-6-14(13)24(22,23)18-11-9-17(10-12-18)15-7-3-4-8-16-15/h1-8H,9-12H2 |
| InChIKey | PJFNKTAOOHZYRB-UHFFFAOYSA-N |
| Molecular Weight | 348.377 g/mol |
| SMILES | C=1(N(=O)=O)C(=CC=CC1)S(=O)(=O)N1CCN(C2=NC=CC=C2)CC1 |