| SpectraBase Compound ID | 8OXo4WnLrBQ |
|---|---|
| InChI | InChI=1S/C8H18O2/c1-5-7-8(6-2,9-3)10-4/h5-7H2,1-4H3 |
| InChIKey | KYKSUAPFGPQISC-UHFFFAOYSA-N |
| Mol Weight | 146.23 g/mol |
| Molecular Formula | C8H18O2 |
| Exact Mass | 146.13068 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3b9FvgCLEuQ |
|---|---|
| Name | 3,3-Dimethoxyhexane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.130679818 u |
| Formula | C8H18O2 |
| InChI | InChI=1S/C8H18O2/c1-5-7-8(6-2,9-3)10-4/h5-7H2,1-4H3 |
| InChIKey | KYKSUAPFGPQISC-UHFFFAOYSA-N |
| Molecular Weight | 146.230 g/mol |
| SMILES | COC(OC)(CC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.904926 |