| SpectraBase Compound ID | 2wagSPF4G2t |
|---|---|
| InChI | InChI=1S/C11H20O/c1-5-8-11(12)10(7-3)9(4)6-2/h6,9-10H,2,5,7-8H2,1,3-4H3 |
| InChIKey | VAVVZXDMDZMHPD-UHFFFAOYSA-N |
| Mol Weight | 168.28 g/mol |
| Molecular Formula | C11H20O |
| Exact Mass | 168.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IXZffliehF0 |
|---|---|
| Name | 4-Ethyl-3-methyl-1-octen-5-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.151415263 u |
| Formula | C11H20O |
| InChI | InChI=1S/C11H20O/c1-5-8-11(12)10(7-3)9(4)6-2/h6,9-10H,2,5,7-8H2,1,3-4H3 |
| InChIKey | VAVVZXDMDZMHPD-UHFFFAOYSA-N |
| Molecular Weight | 168.280 g/mol |
| SMILES | C(C)CC(C(C(C=C)C)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943482 |