| SpectraBase Compound ID | BxGTnBVdsZI |
|---|---|
| InChI | InChI=1S/C17H20O2/c1-2-17(18-13-15-9-5-3-6-10-15)19-14-16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3 |
| InChIKey | ANNDAFXCWSPYIU-UHFFFAOYSA-N |
| Mol Weight | 256.34 g/mol |
| Molecular Formula | C17H20O2 |
| Exact Mass | 256.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9ILBGZgxnDf |
|---|---|
| Name | Propanal dibenzyl acetal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.146329882 u |
| Formula | C17H20O2 |
| InChI | InChI=1S/C17H20O2/c1-2-17(18-13-15-9-5-3-6-10-15)19-14-16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3 |
| InChIKey | ANNDAFXCWSPYIU-UHFFFAOYSA-N |
| Molecular Weight | 256.345 g/mol |
| SMILES | C(CC)(OCC1=CC=CC=C1)OCC1=CC=CC=C1 |