| SpectraBase Compound ID | Dx7p0R9rkhJ |
|---|---|
| InChI | InChI=1S/C16H14O2/c1-12-7-9-14(10-8-12)16(18)15(17)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey | UQMXGMDAYCOYFF-UHFFFAOYSA-N |
| Mol Weight | 238.29 g/mol |
| Molecular Formula | C16H14O2 |
| Exact Mass | 238.09938 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 | EHpE2rPBXug |
|---|---|
| Name | 1-(4-Methylphenyl)-3-phenylpropan-1,2-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.099379689 u |
| Formula | C16H14O2 |
| InChI | InChI=1S/C16H14O2/c1-12-7-9-14(10-8-12)16(18)15(17)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey | UQMXGMDAYCOYFF-UHFFFAOYSA-N |
| Molecular Weight | 238.286 g/mol |
| SMILES | C=1C=C(C=CC1C)C(=O)C(=O)CC1=CC=CC=C1 |