| SpectraBase Compound ID | 7D99mbjiwOd |
|---|---|
| InChI | InChI=1S/C15H12O3/c16-13-9-5-2-6-10-15(13)18-11-14(17)12-7-3-1-4-8-12/h1-10H,11H2 |
| InChIKey | UJDSFPNTKNDAMY-UHFFFAOYSA-N |
| Mol Weight | 240.26 g/mol |
| Molecular Formula | C15H12O3 |
| Exact Mass | 240.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DXczjWSmbOh |
|---|---|
| Name | 2-(2-oxo-2-Phenethyloxy)tropone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.078644243 u |
| Formula | C15H12O3 |
| InChI | InChI=1S/C15H12O3/c16-13-9-5-2-6-10-15(13)18-11-14(17)12-7-3-1-4-8-12/h1-10H,11H2 |
| InChIKey | UJDSFPNTKNDAMY-UHFFFAOYSA-N |
| Molecular Weight | 240.258 g/mol |
| SMILES | C1=CC=CC(C(=C1)OCC(C1=CC=CC=C1)=O)=O |