| SpectraBase Compound ID | AtpqGcnbHhm |
|---|---|
| InChI | InChI=1S/C11H16O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,4-6,9-11H2,1H3 |
| InChIKey | GQIWUGHXDNMPAH-UHFFFAOYSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
| SpectraBase Spectrum ID | 9GfVVkYVyRa |
|---|---|
| Name | 4,9-Undecadiyn-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.120115134 u |
| Formula | C11H16O |
| InChI | InChI=1S/C11H16O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,4-6,9-11H2,1H3 |
| InChIKey | GQIWUGHXDNMPAH-UHFFFAOYSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | C(#CCCCC#CCCCO)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946093 |