| SpectraBase Compound ID | IzBXPTZJppk |
|---|---|
| InChI | InChI=1S/C22H44/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-22H2,2H3 |
| InChIKey | SPURMHFLEKVAAS-UHFFFAOYSA-N |
| Mol Weight | 308.6 g/mol |
| Molecular Formula | C22H44 |
| Exact Mass | 308.344301 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5eE26viIte |
|---|---|
| Name | 1-Docosene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.344301417 u |
| Formula | C22H44 |
| InChI | InChI=1S/C22H44/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-22H2,2H3 |
| InChIKey | SPURMHFLEKVAAS-UHFFFAOYSA-N |
| Molecular Weight | 308.594 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCCCCC=C |
| Spectrum/Structure Validation Score (Raman) | 0.973158 |