| SpectraBase Compound ID | ET87P8dCDJD |
|---|---|
| InChI | InChI=1S/C10H18O/c1-4-7-8-9(5-2)10(11)6-3/h3,9-11H,4-5,7-8H2,1-2H3 |
| InChIKey | CUUQUEAUUPYEKK-UHFFFAOYSA-N |
| Mol Weight | 154.25 g/mol |
| Molecular Formula | C10H18O |
| Exact Mass | 154.135765 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FhKjmvpxGMb |
|---|---|
| Name | 4-Ethyl-1-octyn-3-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.135765199 u |
| Formula | C10H18O |
| InChI | InChI=1S/C10H18O/c1-4-7-8-9(5-2)10(11)6-3/h3,9-11H,4-5,7-8H2,1-2H3 |
| InChIKey | CUUQUEAUUPYEKK-UHFFFAOYSA-N |
| Molecular Weight | 154.253 g/mol |
| SMILES | OC(C(CCCC)CC)C#C |
| Spectrum/Structure Validation Score (Raman) | 0.983548 |