| SpectraBase Compound ID | nLWDp2HhQB |
|---|---|
| InChI | InChI=1S/C13H14O4/c1-15-10-5-3-4-9(6-10)12-7-11(16-2)8-13(14)17-12/h3-6,8,12H,7H2,1-2H3 |
| InChIKey | AYCCLPALXAEVMD-UHFFFAOYSA-N |
| Mol Weight | 234.25 g/mol |
| Molecular Formula | C13H14O4 |
| Exact Mass | 234.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JiiYR5CUYEr |
|---|---|
| Name | 4-Methoxy-6-(3-methoxyphenyl)-5,6-dihydro-pyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.089208927 u |
| Formula | C13H14O4 |
| InChI | InChI=1S/C13H14O4/c1-15-10-5-3-4-9(6-10)12-7-11(16-2)8-13(14)17-12/h3-6,8,12H,7H2,1-2H3 |
| InChIKey | AYCCLPALXAEVMD-UHFFFAOYSA-N |
| Molecular Weight | 234.251 g/mol |
| SMILES | C1(C=C(CC(O1)C1=CC(=CC=C1)OC)OC)=O |