| SpectraBase Compound ID | Ao9FmUU3kCF |
|---|---|
| InChI | InChI=1S/C16H30O/c1-4-6-8-10-12-14-16(15(3)17)13-11-9-7-5-2/h14H,4-13H2,1-3H3/b16-14- |
| InChIKey | XUUHDDBQWWIHHE-PEZBUJJGSA-N |
| Mol Weight | 238.41 g/mol |
| Molecular Formula | C16H30O |
| Exact Mass | 238.229666 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4otV94Lotrl |
|---|---|
| Name | (3Z)-3-Hexyl-3-decen-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.229665585 u |
| Formula | C16H30O |
| InChI | InChI=1S/C16H30O/c1-4-6-8-10-12-14-16(15(3)17)13-11-9-7-5-2/h14H,4-13H2,1-3H3/b16-14- |
| InChIKey | XUUHDDBQWWIHHE-PEZBUJJGSA-N |
| Molecular Weight | 238.415 g/mol |
| SMILES | C(\C(=C/CCCCCC)CCCCCC)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964732 |