| SpectraBase Compound ID | Ewnpq6vBbNf |
|---|---|
| InChI | InChI=1S/C15H16O2/c1-2-14-10-13(16)11-15(17-14)9-8-12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3 |
| InChIKey | VNEZNANIGGOMPH-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C15H16O2 |
| Exact Mass | 228.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7mWsUVG3p4f |
|---|---|
| Name | 2-Ethyl-6-phenethylpyran-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.115029753 u |
| Formula | C15H16O2 |
| InChI | InChI=1S/C15H16O2/c1-2-14-10-13(16)11-15(17-14)9-8-12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3 |
| InChIKey | VNEZNANIGGOMPH-UHFFFAOYSA-N |
| Molecular Weight | 228.291 g/mol |
| SMILES | C1=C(OC(=CC1=O)CC)CCC1=CC=CC=C1 |