| SpectraBase Compound ID | D8t1ukLqNGX |
|---|---|
| InChI | InChI=1S/C15H32/c1-5-6-7-8-9-10-11-15(4)13-12-14(2)3/h14-15H,5-13H2,1-4H3 |
| InChIKey | WHEITGBIIYGVLM-UHFFFAOYSA-N |
| Mol Weight | 212.4 g/mol |
| Molecular Formula | C15H32 |
| Exact Mass | 212.250401 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BBafIWtvnJK |
|---|---|
| Name | Tridecane, 2,5-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.250401030 u |
| Formula | C15H32 |
| InChI | InChI=1S/C15H32/c1-5-6-7-8-9-10-11-15(4)13-12-14(2)3/h14-15H,5-13H2,1-4H3 |
| InChIKey | WHEITGBIIYGVLM-UHFFFAOYSA-N |
| Molecular Weight | 212.421 g/mol |
| SMILES | C(C(CCC(C)C)C)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.886319 |