| SpectraBase Compound ID | AN7VIJ2MU55 |
|---|---|
| InChI | InChI=1S/C5H8O5/c1-9-4(7)3(6)5(8)10-2/h3,6H,1-2H3 |
| InChIKey | CXIUHIBOASGVGV-UHFFFAOYSA-N |
| Mol Weight | 148.11 g/mol |
| Molecular Formula | C5H8O5 |
| Exact Mass | 148.037173 g/mol |
| SpectraBase Spectrum ID | 3PDJiJvgE0M |
|---|---|
| Name | Dimethyl-2-hydroxymalonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.037173353 u |
| Formula | C5H8O5 |
| InChI | InChI=1S/C5H8O5/c1-9-4(7)3(6)5(8)10-2/h3,6H,1-2H3 |
| InChIKey | CXIUHIBOASGVGV-UHFFFAOYSA-N |
| Molecular Weight | 148.114 g/mol |
| SMILES | C(O)(C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.986983 |