| SpectraBase Compound ID | JRyDEWHAufT |
|---|---|
| InChI | InChI=1S/C5H4N2O4/c8-3(9)1-2-4(10)7-5(11)6-2/h1H,(H,8,9)(H2,6,7,10,11)/b2-1+ |
| InChIKey | DOIVUUCRTWRYDG-OWOJBTEDSA-N |
| Mol Weight | 156.1 g/mol |
| Molecular Formula | C5H4N2O4 |
| Exact Mass | 156.017107 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7hHAbEcTSrq |
|---|---|
| Name | Acetic acid, (2,5-dioxo-4-imidazolidinylidene)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.017106613 u |
| Formula | C5H4N2O4 |
| InChI | InChI=1S/C5H4N2O4/c8-3(9)1-2-4(10)7-5(11)6-2/h1H,(H,8,9)(H2,6,7,10,11)/b2-1+ |
| InChIKey | DOIVUUCRTWRYDG-OWOJBTEDSA-N |
| SMILES | C1(NC(\C(N1)=C/C(=O)O)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.992471 |