| SpectraBase Compound ID | F2RWeMeJnyk |
|---|---|
| InChI | InChI=1S/C11H20O2/c1-5-6-7-8-9-11(4,13)10(2,3)12/h12-13H,5-7H2,1-4H3 |
| InChIKey | LEZAJSMLGBUDRR-UHFFFAOYSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C11H20O2 |
| Exact Mass | 184.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1sQTgfB7ZAP |
|---|---|
| Name | 2,3-Dimethylnon-4-yne-2,3-diol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.146329882 u |
| Formula | C11H20O2 |
| InChI | InChI=1S/C11H20O2/c1-5-6-7-8-9-11(4,13)10(2,3)12/h12-13H,5-7H2,1-4H3 |
| InChIKey | LEZAJSMLGBUDRR-UHFFFAOYSA-N |
| Molecular Weight | 184.279 g/mol |
| SMILES | CC(C#CCCCC)(C(C)(O)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920701 |