| SpectraBase Compound ID | LCQwo2vM19r |
|---|---|
| InChI | InChI=1S/C17H36/c1-5-9-10-11-12-13-14-15-16-17(6-2,7-3)8-4/h5-16H2,1-4H3 |
| InChIKey | ATKJTFSZIAQJNV-UHFFFAOYSA-N |
| Mol Weight | 240.5 g/mol |
| Molecular Formula | C17H36 |
| Exact Mass | 240.281701 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LPHFPhXiA4l |
|---|---|
| Name | 3,3-Diethyltridecane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.281701159 u |
| Formula | C17H36 |
| InChI | InChI=1S/C17H36/c1-5-9-10-11-12-13-14-15-16-17(6-2,7-3)8-4/h5-16H2,1-4H3 |
| InChIKey | ATKJTFSZIAQJNV-UHFFFAOYSA-N |
| Molecular Weight | 240.475 g/mol |
| SMILES | CCCCCCCCCCC(CC)(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926302 |