| SpectraBase Compound ID | 4proGBPnSE |
|---|---|
| InChI | InChI=1S/C18H18O3/c1-2-21-18(20)13-12-17(19)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3 |
| InChIKey | PMVQNZOSDZOHCO-UHFFFAOYSA-N |
| Mol Weight | 282.34 g/mol |
| Molecular Formula | C18H18O3 |
| Exact Mass | 282.125594 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 | 9WCnp5Bz8T6 |
|---|---|
| Name | Ethyl 4-oxo-4-(4-phenylphenyl)butanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.125594437 u |
| Formula | C18H18O3 |
| InChI | InChI=1S/C18H18O3/c1-2-21-18(20)13-12-17(19)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3 |
| InChIKey | PMVQNZOSDZOHCO-UHFFFAOYSA-N |
| SMILES | C1=CC(C2=CC=C(C=C2)C(CCC(OCC)=O)=O)=CC=C1 |