| SpectraBase Compound ID | 4H0JedFSP7m |
|---|---|
| InChI | InChI=1S/C6H10O3/c1-3-4-9-6(8)5(2)7/h3-4H2,1-2H3 |
| InChIKey | ILPVOWZUBFRIAX-UHFFFAOYSA-N |
| Mol Weight | 130.14 g/mol |
| Molecular Formula | C6H10O3 |
| Exact Mass | 130.062994 g/mol |
| SpectraBase Spectrum ID | GUFovFo7Q3Z |
|---|---|
| Name | Propyl pyruvate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.062994179 u |
| Formula | C6H10O3 |
| InChI | InChI=1S/C6H10O3/c1-3-4-9-6(8)5(2)7/h3-4H2,1-2H3 |
| InChIKey | ILPVOWZUBFRIAX-UHFFFAOYSA-N |
| SMILES | C(C(=O)C)(=O)OCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937161 |