| SpectraBase Compound ID | 4lIzZS4RF5j |
|---|---|
| InChI | InChI=1S/C10H16O/c1-5-9(3)7-8-10(4,11)6-2/h5,11H,6H2,1-4H3/b9-5+ |
| InChIKey | XYRKRLCDCBKVGW-WEVVVXLNSA-N |
| Mol Weight | 152.24 g/mol |
| Molecular Formula | C10H16O |
| Exact Mass | 152.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2PSerSusUEM |
|---|---|
| Name | 6-Octen-4-yn-3-ol, 3,6-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.120115134 u |
| Formula | C10H16O |
| InChI | InChI=1S/C10H16O/c1-5-9(3)7-8-10(4,11)6-2/h5,11H,6H2,1-4H3/b9-5+ |
| InChIKey | XYRKRLCDCBKVGW-WEVVVXLNSA-N |
| Molecular Weight | 152.237 g/mol |
| SMILES | C(\C(=C\C)C)#CC(CC)(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966014 |