| SpectraBase Compound ID | FamnbTYiGnU |
|---|---|
| InChI | InChI=1S/C22H46/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(5-2)6-3/h22H,4-21H2,1-3H3 |
| InChIKey | PEOLXVKASMQSMY-UHFFFAOYSA-N |
| Mol Weight | 310.6 g/mol |
| Molecular Formula | C22H46 |
| Exact Mass | 310.359951 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FsVA8SyNd7A |
|---|---|
| Name | 3-Ethyleicosane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.359951481 u |
| Formula | C22H46 |
| InChI | InChI=1S/C22H46/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(5-2)6-3/h22H,4-21H2,1-3H3 |
| InChIKey | PEOLXVKASMQSMY-UHFFFAOYSA-N |
| Molecular Weight | 310.610 g/mol |
| SMILES | C(CC)(CC)CCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957025 |