| SpectraBase Compound ID | 36jJk176F2l |
|---|---|
| InChI | InChI=1S/C11H18O/c1-5-11(4,9-12)8-6-7-10(2)3/h5,7,9H,1,6,8H2,2-4H3 |
| InChIKey | KOXRVRCPEUVBEP-UHFFFAOYSA-N |
| Mol Weight | 166.26 g/mol |
| Molecular Formula | C11H18O |
| Exact Mass | 166.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6Uj21PR9Pnd |
|---|---|
| Name | 2-Ethenyl-2,6-dimethylhept-5-enal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.135765199 u |
| Formula | C11H18O |
| InChI | InChI=1S/C11H18O/c1-5-11(4,9-12)8-6-7-10(2)3/h5,7,9H,1,6,8H2,2-4H3 |
| InChIKey | KOXRVRCPEUVBEP-UHFFFAOYSA-N |
| Molecular Weight | 166.264 g/mol |
| SMILES | C(C=C)(C=O)(CCC=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.976758 |