| SpectraBase Compound ID | 19ima6P1cGY |
|---|---|
| InChI | InChI=1S/C12H20O/c1-10(2)8-9-12(13)11-6-4-3-5-7-11/h11H,1,3-9H2,2H3 |
| InChIKey | VWHDLVWJXAZMBL-UHFFFAOYSA-N |
| Mol Weight | 180.29 g/mol |
| Molecular Formula | C12H20O |
| Exact Mass | 180.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KtztjYTp5LT |
|---|---|
| Name | 4-Penten-1-one, 1-cyclohexyl-4-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.151415263 u |
| Formula | C12H20O |
| InChI | InChI=1S/C12H20O/c1-10(2)8-9-12(13)11-6-4-3-5-7-11/h11H,1,3-9H2,2H3 |
| InChIKey | VWHDLVWJXAZMBL-UHFFFAOYSA-N |
| Molecular Weight | 180.291 g/mol |
| SMILES | C(=O)(CCC(=C)C)C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948066 |