| SpectraBase Compound ID | IdMIgHtuWgd |
|---|---|
| InChI | InChI=1S/C17H32O/c1-2-3-4-5-6-7-8-12-15-17(18)16-13-10-9-11-14-16/h16H,2-15H2,1H3 |
| InChIKey | NHKLMMPXETWBCM-UHFFFAOYSA-N |
| Mol Weight | 252.4 g/mol |
| Molecular Formula | C17H32O |
| Exact Mass | 252.245316 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7Mwuo42xQNC |
|---|---|
| Name | 1-Cyclohexyl-1-undecanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.245315649 u |
| Formula | C17H32O |
| InChI | InChI=1S/C17H32O/c1-2-3-4-5-6-7-8-12-15-17(18)16-13-10-9-11-14-16/h16H,2-15H2,1H3 |
| InChIKey | NHKLMMPXETWBCM-UHFFFAOYSA-N |
| Molecular Weight | 252.442 g/mol |
| SMILES | C(=O)(CCCCCCCCCC)C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.896719 |