| SpectraBase Compound ID | GaSeVHn41Nf |
|---|---|
| InChI | InChI=1S/C20H40O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(21)18-4-2/h3-19H2,1-2H3 |
| InChIKey | JWNKFPGVQQKVQG-UHFFFAOYSA-N |
| Mol Weight | 296.5 g/mol |
| Molecular Formula | C20H40O |
| Exact Mass | 296.307916 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CsbQIzrUXXw |
|---|---|
| Name | 4-Eicosanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.307915907 u |
| Formula | C20H40O |
| InChI | InChI=1S/C20H40O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(21)18-4-2/h3-19H2,1-2H3 |
| InChIKey | JWNKFPGVQQKVQG-UHFFFAOYSA-N |
| Molecular Weight | 296.539 g/mol |
| SMILES | C(=O)(CCC)CCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.874462 |