| SpectraBase Compound ID | 5Ay9BYyvw8B |
|---|---|
| InChI | InChI=1S/C21H28O/c1-3-4-7-16-20(18-12-8-5-9-13-18)17-21(22-2)19-14-10-6-11-15-19/h5-6,8-15,20-21H,3-4,7,16-17H2,1-2H3 |
| InChIKey | XNWXMRYTGNXPBJ-UHFFFAOYSA-N |
| Mol Weight | 296.45 g/mol |
| Molecular Formula | C21H28O |
| Exact Mass | 296.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JDfcSqyx0h6 |
|---|---|
| Name | 1-Methoxy-1,3-diphenyloctane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.214015521 u |
| Formula | C21H28O |
| InChI | InChI=1S/C21H28O/c1-3-4-7-16-20(18-12-8-5-9-13-18)17-21(22-2)19-14-10-6-11-15-19/h5-6,8-15,20-21H,3-4,7,16-17H2,1-2H3 |
| InChIKey | XNWXMRYTGNXPBJ-UHFFFAOYSA-N |
| SMILES | C(CC(CCCCC)C=1C=CC=CC1)(C=1C=CC=CC1)OC |