| SpectraBase Compound ID | 6VB8CykiCw0 |
|---|---|
| InChI | InChI=1S/C16H26O2/c1-13(2)11-17-16(18-12-14(3)4)10-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3 |
| InChIKey | IORFKGJOBOCHPX-UHFFFAOYSA-N |
| Mol Weight | 250.38 g/mol |
| Molecular Formula | C16H26O2 |
| Exact Mass | 250.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2LOgFcI4qoS |
|---|---|
| Name | Phenylacetaldehyde diisobutyl acetal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.193280075 u |
| Formula | C16H26O2 |
| InChI | InChI=1S/C16H26O2/c1-13(2)11-17-16(18-12-14(3)4)10-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3 |
| InChIKey | IORFKGJOBOCHPX-UHFFFAOYSA-N |
| Molecular Weight | 250.382 g/mol |
| SMILES | CC(C)COC(CC1=CC=CC=C1)OCC(C)C |