| SpectraBase Compound ID | 8GzIGEryaOc |
|---|---|
| InChI | InChI=1S/C11H20O/c1-4-7-9-10(6-3)11(12)8-5-2/h7,9-10H,4-6,8H2,1-3H3/b9-7+ |
| InChIKey | PEMAASKZPRIXGX-VQHVLOKHSA-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 | IipZwdtvGNI |
|---|---|
| Name | 5-Ethyl-3-nonen-6-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/c1-4-7-9-10(6-3)11(12)8-5-2/h7,9-10H,4-6,8H2,1-3H3/b9-7+ |
| InChIKey | PEMAASKZPRIXGX-VQHVLOKHSA-N |
| Molecular Weight | 168.280 g/mol |
| SMILES | C(C(C(\C=C\CC)CC)=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.945826 |