| SpectraBase Compound ID | CFtupeocZeA |
|---|---|
| InChI | InChI=1S/C16H34O2/c1-4-7-10-13-16(17-14-11-8-5-2)18-15-12-9-6-3/h16H,4-15H2,1-3H3 |
| InChIKey | MXIMWAJQWMYBAJ-UHFFFAOYSA-N |
| Mol Weight | 258.4 g/mol |
| Molecular Formula | C16H34O2 |
| Exact Mass | 258.25588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8OGYvKlkz1Q |
|---|---|
| Name | Hexanal dipentyl acetal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.255880333 u |
| Formula | C16H34O2 |
| InChI | InChI=1S/C16H34O2/c1-4-7-10-13-16(17-14-11-8-5-2)18-15-12-9-6-3/h16H,4-15H2,1-3H3 |
| InChIKey | MXIMWAJQWMYBAJ-UHFFFAOYSA-N |
| Molecular Weight | 258.446 g/mol |
| SMILES | C(CCCCC)(OCCCCC)OCCCCC |