| SpectraBase Compound ID | BEKZ2IrvlKf |
|---|---|
| InChI | InChI=1S/C12H22O/c1-4-7-8-10-12(13)11(6-3)9-5-2/h8,10-11H,4-7,9H2,1-3H3/b10-8+ |
| InChIKey | UJQGKPVTWJPSRA-CSKARUKUSA-N |
| Mol Weight | 182.31 g/mol |
| Molecular Formula | C12H22O |
| Exact Mass | 182.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AyxzKijSdnd |
|---|---|
| Name | 7-Ethyl-4-decen-6-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.167065327 u |
| Formula | C12H22O |
| InChI | InChI=1S/C12H22O/c1-4-7-8-10-12(13)11(6-3)9-5-2/h8,10-11H,4-7,9H2,1-3H3/b10-8+ |
| InChIKey | UJQGKPVTWJPSRA-CSKARUKUSA-N |
| Molecular Weight | 182.307 g/mol |
| SMILES | C(CCC)(C(\C=C\CCC)=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.861433 |