| SpectraBase Compound ID | 1kpVSFH9XHf |
|---|---|
| InChI | InChI=1S/C18H36/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h13,15H,3-12,14,16-18H2,1-2H3/b15-13+ |
| InChIKey | VBDYOHYDAONYJK-FYWRMAATSA-N |
| Mol Weight | 252.5 g/mol |
| Molecular Formula | C18H36 |
| Exact Mass | 252.281701 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ILtt7SkCVM0 |
|---|---|
| Name | E-7-Octadecene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.281701159 u |
| Formula | C18H36 |
| InChI | InChI=1S/C18H36/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h13,15H,3-12,14,16-18H2,1-2H3/b15-13+ |
| InChIKey | VBDYOHYDAONYJK-FYWRMAATSA-N |
| Molecular Weight | 252.486 g/mol |
| SMILES | CCCCCCCCCC\C=C\CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951822 |