| SpectraBase Compound ID | 2qz1wUi7vkc |
|---|---|
| InChI | InChI=1S/C8H9N3O4S/c9-8(13)11-16(14,15)7-3-1-6(2-4-7)10-5-12/h1-5H,(H,10,12)(H3,9,11,13) |
| InChIKey | WUJQLUPIWRMIOJ-UHFFFAOYSA-N |
| Mol Weight | 243.24 g/mol |
| Molecular Formula | C8H9N3O4S |
| Exact Mass | 243.031377 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 21AshAZKRns |
|---|---|
| Name | (N-Formylsulfanilyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.031376952 u |
| Formula | C8H9N3O4S |
| InChI | InChI=1S/C8H9N3O4S/c9-8(13)11-16(14,15)7-3-1-6(2-4-7)10-5-12/h1-5H,(H,10,12)(H3,9,11,13) |
| InChIKey | WUJQLUPIWRMIOJ-UHFFFAOYSA-N |
| SMILES | N(S(C1=CC=C(C=C1)NC=O)(=O)=O)C(=O)N |