| SpectraBase Compound ID | KvU21l5imRL |
|---|---|
| InChI | InChI=1S/C18H20O2/c19-18(16-10-4-1-5-11-16)14-8-3-9-15-20-17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2 |
| InChIKey | NHTHHQOYZAIPDM-UHFFFAOYSA-N |
| Mol Weight | 268.36 g/mol |
| Molecular Formula | C18H20O2 |
| Exact Mass | 268.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BqdmQmOhRAz |
|---|---|
| Name | 6-Phenoxy-1-phenyl-1-hexanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.146329882 u |
| Formula | C18H20O2 |
| InChI | InChI=1S/C18H20O2/c19-18(16-10-4-1-5-11-16)14-8-3-9-15-20-17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2 |
| InChIKey | NHTHHQOYZAIPDM-UHFFFAOYSA-N |
| SMILES | C(=O)(C=1C=CC=CC1)CCCCCOC=1C=CC=CC1 |