![2-phenylpyrimido[1,2-a]benzimidazol-4(1H)-one](/api/spectrum/3eTguCZFScd/structure.png?h=300&w=458 "2-phenylpyrimido[1,2-a]benzimidazol-4(1H)-one")
| SpectraBase Compound ID | 9MNtlz6HucN |
|---|---|
| InChI | InChI=1S/C16H11N3O/c20-15-10-13(11-6-2-1-3-7-11)18-16-17-12-8-4-5-9-14(12)19(15)16/h1-10H,(H,17,18) |
| InChIKey | BBERZJLEIXBTKK-UHFFFAOYSA-N |
| Mol Weight | 261.28 g/mol |
| Molecular Formula | C16H11N3O |
| Exact Mass | 261.090212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3eTguCZFScd |
|---|---|
| Name | 2-Phenylpyrimido[1,2-A]benzimidazol-4(1H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.090211985 u |
| Formula | C16H11N3O |
| InChI | InChI=1S/C16H11N3O/c20-15-10-13(11-6-2-1-3-7-11)18-16-17-12-8-4-5-9-14(12)19(15)16/h1-10H,(H,17,18) |
| InChIKey | BBERZJLEIXBTKK-UHFFFAOYSA-N |
| Molecular Weight | 261.284 g/mol |
| SMILES | N1C(=CC(N2C1=NC1=C2C=CC=C1)=O)C1=CC=CC=C1 |