| SpectraBase Compound ID | 8zbFR5MvlRN |
|---|---|
| InChI | InChI=1S/C13H14O2/c1-9-3-5-11(6-4-9)13-8-12(14)7-10(2)15-13/h3-7,13H,8H2,1-2H3 |
| InChIKey | WYLOJBKPSHGYJZ-UHFFFAOYSA-N |
| Mol Weight | 202.25 g/mol |
| Molecular Formula | C13H14O2 |
| Exact Mass | 202.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L0ut9uIv3cY |
|---|---|
| Name | 2,3-Dihydro-6-methyl-2-(4-methylphenyl)-4H-pyran-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.099379689 u |
| Formula | C13H14O2 |
| InChI | InChI=1S/C13H14O2/c1-9-3-5-11(6-4-9)13-8-12(14)7-10(2)15-13/h3-7,13H,8H2,1-2H3 |
| InChIKey | WYLOJBKPSHGYJZ-UHFFFAOYSA-N |
| Molecular Weight | 202.253 g/mol |
| SMILES | C1(CC(C=C(O1)C)=O)C=1C=CC(=CC1)C |