| SpectraBase Compound ID | IqGx9U8UBzY |
|---|---|
| InChI | InChI=1S/C17H36O2/c1-4-7-10-12-15-18-17(14-9-6-3)19-16-13-11-8-5-2/h17H,4-16H2,1-3H3 |
| InChIKey | JQWXFZZZKPDRKK-UHFFFAOYSA-N |
| Mol Weight | 272.5 g/mol |
| Molecular Formula | C17H36O2 |
| Exact Mass | 272.27153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kz4w9s6tcsK |
|---|---|
| Name | Valeraldehyde dihexyl acetal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.271530397 u |
| Formula | C17H36O2 |
| InChI | InChI=1S/C17H36O2/c1-4-7-10-12-15-18-17(14-9-6-3)19-16-13-11-8-5-2/h17H,4-16H2,1-3H3 |
| InChIKey | JQWXFZZZKPDRKK-UHFFFAOYSA-N |
| Molecular Weight | 272.473 g/mol |
| SMILES | C(CCCC)(OCCCCCC)OCCCCCC |