| SpectraBase Compound ID | K1z1kTlYrc1 |
|---|---|
| InChI | InChI=1S/C7H10O4/c1-9-7(10-2)5-6(8)3-4-11-7/h3-4H,5H2,1-2H3 |
| InChIKey | ZMZGNHVJINDYBT-UHFFFAOYSA-N |
| Mol Weight | 158.15 g/mol |
| Molecular Formula | C7H10O4 |
| Exact Mass | 158.057909 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EbCYoHVf6zI |
|---|---|
| Name | 2,2-Dimethoxy-3H-pyran-4-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.057908798 u |
| Formula | C7H10O4 |
| InChI | InChI=1S/C7H10O4/c1-9-7(10-2)5-6(8)3-4-11-7/h3-4H,5H2,1-2H3 |
| InChIKey | ZMZGNHVJINDYBT-UHFFFAOYSA-N |
| SMILES | C1(CC(=O)C=CO1)(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.829254 |