| SpectraBase Compound ID | 78CYokH5Qaf |
|---|---|
| InChI | InChI=1S/C10H18O/c1-5-10(11)7-9(4)6-8(2)3/h9H,2,5-7H2,1,3-4H3 |
| InChIKey | DCFFEFYNSLNQLA-UHFFFAOYSA-N |
| Mol Weight | 154.25 g/mol |
| Molecular Formula | C10H18O |
| Exact Mass | 154.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IF110MHsQjJ |
|---|---|
| Name | 5,7-Dimethyl-7-octen-3-one |
| 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/c1-5-10(11)7-9(4)6-8(2)3/h9H,2,5-7H2,1,3-4H3 |
| InChIKey | DCFFEFYNSLNQLA-UHFFFAOYSA-N |
| Molecular Weight | 154.253 g/mol |
| SMILES | C(=C)(CC(CC(=O)CC)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958174 |