![N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide](/api/spectrum/IVteAJTYSyL/structure.png?h=300&w=458 "N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide")
| SpectraBase Compound ID | 6YTJvP9DMkn |
|---|---|
| InChI | InChI=1S/C10H8N4O3S/c1-6(15)11-10-13-12-9(18-10)7-2-4-8(5-3-7)14(16)17/h2-5H,1H3,(H,11,13,15) |
| InChIKey | KTJUGKNFZGGFIC-UHFFFAOYSA-N |
| Mol Weight | 264.26 g/mol |
| Molecular Formula | C10H8N4O3S |
| Exact Mass | 264.031711 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVteAJTYSyL |
|---|---|
| Name | N-[5-(4-Nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.031711305 u |
| Formula | C10H8N4O3S |
| InChI | InChI=1S/C10H8N4O3S/c1-6(15)11-10-13-12-9(18-10)7-2-4-8(5-3-7)14(16)17/h2-5H,1H3,(H,11,13,15) |
| InChIKey | KTJUGKNFZGGFIC-UHFFFAOYSA-N |
| Molecular Weight | 264.259 g/mol |
| SMILES | C(C)(=O)NC=1SC(C2=CC=C(C=C2)N(=O)=O)=NN1 |