| SpectraBase Compound ID | D0aexdX3wiy |
|---|---|
| InChI | InChI=1S/C6H10O3/c1-4(2)5(3-7)6(8)9/h7H,3H2,1-2H3,(H,8,9) |
| InChIKey | DNXPNXIKCYAOSY-UHFFFAOYSA-N |
| Mol Weight | 130.14 g/mol |
| Molecular Formula | C6H10O3 |
| Exact Mass | 130.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | L56eE7HQ2rG |
|---|---|
| Name | Propionic acid, 3-hydroxy-2-isopropylidene- |
| 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/c1-4(2)5(3-7)6(8)9/h7H,3H2,1-2H3,(H,8,9) |
| InChIKey | DNXPNXIKCYAOSY-UHFFFAOYSA-N |
| SMILES | CC(C)=C(CO)C(O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884159 |