| SpectraBase Compound ID | CdvJV2irD8B |
|---|---|
| InChI | InChI=1S/C10H16N2O4/c1-3-6(13)5-10(4-2)7(14)11-9(16)12-8(10)15/h6,13H,3-5H2,1-2H3,(H2,11,12,14,15,16) |
| InChIKey | DFSRCCCREWOIAC-UHFFFAOYSA-N |
| Mol Weight | 228.25 g/mol |
| Molecular Formula | C10H16N2O4 |
| Exact Mass | 228.111007 g/mol |
Raman Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Ku1KCZSWI9k |
|---|---|
| Name | 5-Ethyl-5-(2-hydroxybutyl)barbituric acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.111006999 u |
| Formula | C10H16N2O4 |
| InChI | InChI=1S/C10H16N2O4/c1-3-6(13)5-10(4-2)7(14)11-9(16)12-8(10)15/h6,13H,3-5H2,1-2H3,(H2,11,12,14,15,16) |
| InChIKey | DFSRCCCREWOIAC-UHFFFAOYSA-N |
| SMILES | N1C(C(CC(O)CC)(C(NC1=O)=O)CC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.985144 |