| SpectraBase Compound ID | GWZGoWgOyJo |
|---|---|
| InChI | InChI=1S/C13H22O/c1-3-12(13(14)4-2)10-11-8-6-5-7-9-11/h10-11H,3-9H2,1-2H3/b12-10+ |
| InChIKey | UYSAIZLMBOMORH-ZRDIBKRKSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 54syZAXOVkW |
|---|---|
| Name | 1-Cyclohexyl-2-ethyl-1-penten-3-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.167065327 u |
| Formula | C13H22O |
| InChI | InChI=1S/C13H22O/c1-3-12(13(14)4-2)10-11-8-6-5-7-9-11/h10-11H,3-9H2,1-2H3/b12-10+ |
| InChIKey | UYSAIZLMBOMORH-ZRDIBKRKSA-N |
| Molecular Weight | 194.318 g/mol |
| SMILES | C1(\C=C\(C(=O)CC)CC)CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.856333 |