| SpectraBase Compound ID | 5b8M42aBGUD |
|---|---|
| InChI | InChI=1S/C12H11N3O/c1-9(16)14-12-13-8-7-11(15-12)10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14,15,16) |
| InChIKey | SGZJEEMPTWMLKL-UHFFFAOYSA-N |
| Mol Weight | 213.24 g/mol |
| Molecular Formula | C12H11N3O |
| Exact Mass | 213.090212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AzRy0vI3SKv |
|---|---|
| Name | Pyrimidine, 2-acetylamino-4-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.090211985 u |
| Formula | C12H11N3O |
| InChI | InChI=1S/C12H11N3O/c1-9(16)14-12-13-8-7-11(15-12)10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14,15,16) |
| InChIKey | SGZJEEMPTWMLKL-UHFFFAOYSA-N |
| Molecular Weight | 213.240 g/mol |
| SMILES | C1=CC=CC=C1C1=CC=NC(=N1)NC(C)=O |