| SpectraBase Compound ID | 4bsZKPiEbZh |
|---|---|
| InChI | InChI=1S/C11H16O/c1-10(9-12)7-8-11-5-3-2-4-6-11/h7-9H,2-6H2,1H3/b10-7+ |
| InChIKey | LMKOSFPJFISTCW-JXMROGBWSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JlQc0MYidTA |
|---|---|
| Name | (E)-4-Cyclohexylidene-2-methylbut-2-enal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.120115134 u |
| Formula | C11H16O |
| InChI | InChI=1S/C11H16O/c1-10(9-12)7-8-11-5-3-2-4-6-11/h7-9H,2-6H2,1H3/b10-7+ |
| InChIKey | LMKOSFPJFISTCW-JXMROGBWSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | C(\C(=C\C=C1CCCCC1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973348 |