![2-[3-(4-Methoxyphenyl)-3-oxopropyl]cyclohexanone](/api/spectrum/6zihvFhAdAb/structure.png?h=300&w=458 "2-[3-(4-Methoxyphenyl)-3-oxopropyl]cyclohexanone")
| SpectraBase Compound ID | 4MPGtZtYAxI |
|---|---|
| InChI | InChI=1S/C16H20O3/c1-19-14-9-6-13(7-10-14)16(18)11-8-12-4-2-3-5-15(12)17/h6-7,9-10,12H,2-5,8,11H2,1H3 |
| InChIKey | BNAFQQVBCCSNHM-UHFFFAOYSA-N |
| Mol Weight | 260.33 g/mol |
| Molecular Formula | C16H20O3 |
| Exact Mass | 260.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6zihvFhAdAb |
|---|---|
| Name | 2-[3-(4-Methoxyphenyl)-3-oxopropyl]cyclohexanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.141244501 u |
| Formula | C16H20O3 |
| InChI | InChI=1S/C16H20O3/c1-19-14-9-6-13(7-10-14)16(18)11-8-12-4-2-3-5-15(12)17/h6-7,9-10,12H,2-5,8,11H2,1H3 |
| InChIKey | BNAFQQVBCCSNHM-UHFFFAOYSA-N |
| Molecular Weight | 260.333 g/mol |
| SMILES | C(C=1C=CC(=CC1)OC)(CCC1C(=O)CCCC1)=O |