| SpectraBase Compound ID | 5ce69EUjBkl |
|---|---|
| InChI | InChI=1S/C16H14O2/c1-2-6-11-7-5-9-13-15(17)12-8-3-4-10-14(12)18-16(11)13/h3-5,7-10H,2,6H2,1H3 |
| InChIKey | XJIOYXXSJVILAQ-UHFFFAOYSA-N |
| Mol Weight | 238.29 g/mol |
| Molecular Formula | C16H14O2 |
| Exact Mass | 238.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNVTUhYfUaM |
|---|---|
| Name | 4-Propylxanthen-9-one |
| 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/c1-2-6-11-7-5-9-13-15(17)12-8-3-4-10-14(12)18-16(11)13/h3-5,7-10H,2,6H2,1H3 |
| InChIKey | XJIOYXXSJVILAQ-UHFFFAOYSA-N |
| Molecular Weight | 238.286 g/mol |
| SMILES | C(CC1=C2C(=CC=C1)C(C=1C(=CC=CC1)O2)=O)C |