| SpectraBase Compound ID | JBqMGCIvC5h |
|---|---|
| InChI | InChI=1S/C13H26O3/c1-3-5-6-7-8-9-10-11-12(14)13(15)16-4-2/h12,14H,3-11H2,1-2H3 |
| InChIKey | QHKCPWIESMUWEV-UHFFFAOYSA-N |
| Mol Weight | 230.35 g/mol |
| Molecular Formula | C13H26O3 |
| Exact Mass | 230.188195 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BOWdj5JioLo |
|---|---|
| Name | Ethyl 2-hydroxyundecanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.188194694 u |
| Formula | C13H26O3 |
| InChI | InChI=1S/C13H26O3/c1-3-5-6-7-8-9-10-11-12(14)13(15)16-4-2/h12,14H,3-11H2,1-2H3 |
| InChIKey | QHKCPWIESMUWEV-UHFFFAOYSA-N |
| Molecular Weight | 230.348 g/mol |
| SMILES | C(=O)(C(O)CCCCCCCCC)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947765 |