| SpectraBase Compound ID | 3Kk5HfBb2KK |
|---|---|
| InChI | InChI=1S/C6H12O3/c1-3-4-6(2,9)5(7)8/h9H,3-4H2,1-2H3,(H,7,8) |
| InChIKey | BIEZUWIUHAKFHZ-UHFFFAOYSA-N |
| Mol Weight | 132.16 g/mol |
| Molecular Formula | C6H12O3 |
| Exact Mass | 132.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4hTUWejij4w |
|---|---|
| Name | 2-Hydroxy-2-methylpentanoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.078644243 u |
| Formula | C6H12O3 |
| InChI | InChI=1S/C6H12O3/c1-3-4-6(2,9)5(7)8/h9H,3-4H2,1-2H3,(H,7,8) |
| InChIKey | BIEZUWIUHAKFHZ-UHFFFAOYSA-N |
| SMILES | C(C(CCC)(C)O)(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9462 |