| SpectraBase Compound ID | ICDmyWlPcF9 |
|---|---|
| InChI | InChI=1S/C9H8N4O2/c10-8(14)12-9-11-7(13-15-9)6-4-2-1-3-5-6/h1-5H,(H3,10,11,12,13,14) |
| InChIKey | LMIXYJYVSQYMNF-UHFFFAOYSA-N |
| Mol Weight | 204.19 g/mol |
| Molecular Formula | C9H8N4O2 |
| Exact Mass | 204.064726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8iIJxsoKQUg |
|---|---|
| Name | 3-Phenyl-5-ureido-1,2,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.064725512 u |
| Formula | C9H8N4O2 |
| InChI | InChI=1S/C9H8N4O2/c10-8(14)12-9-11-7(13-15-9)6-4-2-1-3-5-6/h1-5H,(H3,10,11,12,13,14) |
| InChIKey | LMIXYJYVSQYMNF-UHFFFAOYSA-N |
| SMILES | N(C=1ON=C(N1)C1=CC=CC=C1)C(N)=O |