| SpectraBase Compound ID | 8TCPpK4t9vn |
|---|---|
| InChI | InChI=1S/C13H28O2/c1-5-9-15-10-7-6-8-13(4,14)11-12(2)3/h12,14H,5-11H2,1-4H3 |
| InChIKey | WNVCGATXLCZCDV-UHFFFAOYSA-N |
| Mol Weight | 216.36 g/mol |
| Molecular Formula | C13H28O2 |
| Exact Mass | 216.20893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ge8gn2xXFxt |
|---|---|
| Name | 9-Oxadodecan-4-ol, 2,4-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.208930140 u |
| Formula | C13H28O2 |
| InChI | InChI=1S/C13H28O2/c1-5-9-15-10-7-6-8-13(4,14)11-12(2)3/h12,14H,5-11H2,1-4H3 |
| InChIKey | WNVCGATXLCZCDV-UHFFFAOYSA-N |
| Molecular Weight | 216.365 g/mol |
| SMILES | CC(CC(C)C)(CCCCOCCC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947422 |