| SpectraBase Compound ID | D40aGIeUCDz |
|---|---|
| InChI | InChI=1S/C14H28/c1-13-11-9-7-5-4-6-8-10-12-14(13,2)3/h13H,4-12H2,1-3H3 |
| InChIKey | HMFAVPQMBDCNQH-UHFFFAOYSA-N |
| Mol Weight | 196.38 g/mol |
| Molecular Formula | C14H28 |
| Exact Mass | 196.219101 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LxExfxTyrId |
|---|---|
| Name | Cycloundecane, 1,1,2-trimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.219100902 u |
| Formula | C14H28 |
| InChI | InChI=1S/C14H28/c1-13-11-9-7-5-4-6-8-10-12-14(13,2)3/h13H,4-12H2,1-3H3 |
| InChIKey | HMFAVPQMBDCNQH-UHFFFAOYSA-N |
| Molecular Weight | 196.378 g/mol |
| SMILES | C1(C)(C)C(C)CCCCCCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.803217 |