| SpectraBase Compound ID | JoqmQDO4wo1 |
|---|---|
| InChI | InChI=1S/C17H32O2/c1-4-13-16(2)14-11-9-7-5-6-8-10-12-15-19-17(3)18/h4,13,16H,5-12,14-15H2,1-3H3/b13-4+ |
| InChIKey | XXLYWWIKAYGTIH-YIXHJXPBSA-N |
| Mol Weight | 268.4 g/mol |
| Molecular Formula | C17H32O2 |
| Exact Mass | 268.24023 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9SULCR70xZs |
|---|---|
| Name | E-11-Methyl-12-tetradecen-1-ol acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.240230268 u |
| Formula | C17H32O2 |
| InChI | InChI=1S/C17H32O2/c1-4-13-16(2)14-11-9-7-5-6-8-10-12-15-19-17(3)18/h4,13,16H,5-12,14-15H2,1-3H3/b13-4+ |
| InChIKey | XXLYWWIKAYGTIH-YIXHJXPBSA-N |
| SMILES | C(\C=C\C)(CCCCCCCCCCOC(=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.892698 |