| SpectraBase Compound ID | Rsb9TRqqPs |
|---|---|
| InChI | InChI=1S/C14H28O2/c1-10(2)7-12(5)9-14(8-11(3)4)16-13(6)15/h10-12,14H,7-9H2,1-6H3 |
| InChIKey | HPFLRIHGHUFYEG-UHFFFAOYSA-N |
| Mol Weight | 228.38 g/mol |
| Molecular Formula | C14H28O2 |
| Exact Mass | 228.20893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5PG5KfIBmGZ |
|---|---|
| Name | 2,6,8-Trimethyl-4-nonyl acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.208930140 u |
| Formula | C14H28O2 |
| InChI | InChI=1S/C14H28O2/c1-10(2)7-12(5)9-14(8-11(3)4)16-13(6)15/h10-12,14H,7-9H2,1-6H3 |
| InChIKey | HPFLRIHGHUFYEG-UHFFFAOYSA-N |
| Molecular Weight | 228.376 g/mol |
| SMILES | C(C)(=O)OC(CC(C)C)CC(CC(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.846689 |