| SpectraBase Compound ID | 3rD4tj2nyOd |
|---|---|
| InChI | InChI=1S/C17H18O2/c1-3-16(13-7-5-4-6-8-13)17(18)14-9-11-15(19-2)12-10-14/h4-12,16H,3H2,1-2H3 |
| InChIKey | IADSVVKUBCYPIR-UHFFFAOYSA-N |
| Mol Weight | 254.33 g/mol |
| Molecular Formula | C17H18O2 |
| Exact Mass | 254.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GD2NLIfhcv8 |
|---|---|
| Name | 1-(4-Methoxyphenyl)-2-phenylbutan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.130679818 u |
| Formula | C17H18O2 |
| InChI | InChI=1S/C17H18O2/c1-3-16(13-7-5-4-6-8-13)17(18)14-9-11-15(19-2)12-10-14/h4-12,16H,3H2,1-2H3 |
| InChIKey | IADSVVKUBCYPIR-UHFFFAOYSA-N |
| Molecular Weight | 254.329 g/mol |
| SMILES | CCC(C1=CC=CC=C1)C(C1=CC=C(C=C1)OC)=O |