| SpectraBase Compound ID | 172KX8SAdM9 |
|---|---|
| InChI | InChI=1S/C10H20O3/c1-9(2,3)6-8(11)13-7-10(4,5)12/h12H,6-7H2,1-5H3 |
| InChIKey | MUVXZFQBDNGKOV-UHFFFAOYSA-N |
| Mol Weight | 188.27 g/mol |
| Molecular Formula | C10H20O3 |
| Exact Mass | 188.141245 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2zRhKXFT9q |
|---|---|
| Name | (2-Methyl-2-oxidanyl-propyl) 3,3-dimethylbutanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.141244501 u |
| Formula | C10H20O3 |
| InChI | InChI=1S/C10H20O3/c1-9(2,3)6-8(11)13-7-10(4,5)12/h12H,6-7H2,1-5H3 |
| InChIKey | MUVXZFQBDNGKOV-UHFFFAOYSA-N |
| Molecular Weight | 188.267 g/mol |
| SMILES | C(CC(C)(C)C)(=O)OCC(C)(C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.987801 |