| SpectraBase Compound ID | 2tljYeQPey0 |
|---|---|
| InChI | InChI=1S/C16H16O2/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-12H,4,7,13H2 |
| InChIKey | QHGQHHFBINKXLT-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C16H16O2 |
| Exact Mass | 240.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | cmmScLDTFq |
|---|---|
| Name | Propanal, 3-(4-benzyloxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.115029753 u |
| Formula | C16H16O2 |
| InChI | InChI=1S/C16H16O2/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-12H,4,7,13H2 |
| InChIKey | QHGQHHFBINKXLT-UHFFFAOYSA-N |
| Molecular Weight | 240.302 g/mol |
| SMILES | C1=CC(COC2=CC=C(CCC=O)C=C2)=CC=C1 |