| SpectraBase Compound ID | BIukwX85Z2U |
|---|---|
| InChI | InChI=1S/C13H22O/c1-3-5-7-8-10-12-13(14)11-9-6-4-2/h9,11,13-14H,3-8H2,1-2H3/b11-9- |
| InChIKey | IMHCRFJCTBNQEJ-LUAWRHEFSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3TBw2dJnJtB |
|---|---|
| Name | 1-Ethyl-2-undecen-5-yn-4-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.167065327 u |
| Formula | C13H22O |
| InChI | InChI=1S/C13H22O/c1-3-5-7-8-10-12-13(14)11-9-6-4-2/h9,11,13-14H,3-8H2,1-2H3/b11-9- |
| InChIKey | IMHCRFJCTBNQEJ-LUAWRHEFSA-N |
| Molecular Weight | 194.318 g/mol |
| SMILES | C(#CCCCCC)C(\C=C/CCC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948414 |