| SpectraBase Compound ID | KeRROtsnxXX |
|---|---|
| InChI | InChI=1S/C7H10O3/c1-7(2)4-5(8)3-6(9)10-7/h3-4H2,1-2H3 |
| InChIKey | UMZODYOZUBWCCB-UHFFFAOYSA-N |
| Mol Weight | 142.15 g/mol |
| Molecular Formula | C7H10O3 |
| Exact Mass | 142.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4tB5NOuwLR6 |
|---|---|
| Name | 2H-Pyran-2,4(3H)-dione, dihydro-6,6-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.062994179 u |
| Formula | C7H10O3 |
| InChI | InChI=1S/C7H10O3/c1-7(2)4-5(8)3-6(9)10-7/h3-4H2,1-2H3 |
| InChIKey | UMZODYOZUBWCCB-UHFFFAOYSA-N |
| SMILES | C1(OC(C)(C)CC(C1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966189 |