| SpectraBase Compound ID | 8SpsIDucMjd |
|---|---|
| InChI | InChI=1S/C16H14O/c1-12-8-10-14(11-9-12)13(2)16(17)15-6-4-3-5-7-15/h3-11H,2H2,1H3 |
| InChIKey | KGEBLBOCSBEAGA-UHFFFAOYSA-N |
| Mol Weight | 222.29 g/mol |
| Molecular Formula | C16H14O |
| Exact Mass | 222.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CtqPlnfhNS2 |
|---|---|
| Name | 1-Phenyl-2-(p-tolyl)prop-2-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.104465070 u |
| Formula | C16H14O |
| InChI | InChI=1S/C16H14O/c1-12-8-10-14(11-9-12)13(2)16(17)15-6-4-3-5-7-15/h3-11H,2H2,1H3 |
| InChIKey | KGEBLBOCSBEAGA-UHFFFAOYSA-N |
| Molecular Weight | 222.287 g/mol |
| SMILES | C(C(=O)C=1C=CC=CC1)(C=1C=CC(=CC1)C)=C |