| SpectraBase Compound ID | 2ngOIVLHqfv |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-5-8(11)7-9(12)10(3,4)6-2/h5-6,8,11H,1-2,7H2,3-4H3 |
| InChIKey | MUGONKKJCINWRJ-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5LHI6rRCUiS |
|---|---|
| Name | 6-Hydroxy-3,3-dimethyl-1,7-octadien-4-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-5-8(11)7-9(12)10(3,4)6-2/h5-6,8,11H,1-2,7H2,3-4H3 |
| InChIKey | MUGONKKJCINWRJ-UHFFFAOYSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C(C(C=C)(C)C)(CC(C=C)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87581 |