| SpectraBase Compound ID | FUQAT60mjcj |
|---|---|
| InChI | InChI=1S/C6H8N2O2/c1-2-8-4-3-5(9)7-6(8)10/h3-4H,2H2,1H3,(H,7,9,10) |
| InChIKey | KPLDRYODCDLNHB-UHFFFAOYSA-N |
| Mol Weight | 140.14 g/mol |
| Molecular Formula | C6H8N2O2 |
| Exact Mass | 140.058578 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2ltQ7PY0ty5 |
|---|---|
| Name | 1-Ethylpyrimidine-2,4(1H,3H)-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.058577504 u |
| Formula | C6H8N2O2 |
| InChI | InChI=1S/C6H8N2O2/c1-2-8-4-3-5(9)7-6(8)10/h3-4H,2H2,1H3,(H,7,9,10) |
| InChIKey | KPLDRYODCDLNHB-UHFFFAOYSA-N |
| Molecular Weight | 140.142 g/mol |
| SMILES | C1(=O)NC(=O)C=CN1CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981158 |