![4-(4-Methylphenyl)-7-methyl-3,4-dihydro-pyrano[4,3-b]pyran-2,5-dione](/api/spectrum/3859noUmjgl/structure.png?h=300&w=458 "4-(4-Methylphenyl)-7-methyl-3,4-dihydro-pyrano[4,3-b]pyran-2,5-dione")
| SpectraBase Compound ID | BXItC4UsUvE |
|---|---|
| InChI | InChI=1S/C16H14O4/c1-9-3-5-11(6-4-9)12-8-14(17)20-13-7-10(2)19-16(18)15(12)13/h3-7,12H,8H2,1-2H3 |
| InChIKey | WAQVQVJYSNMXTR-UHFFFAOYSA-N |
| Mol Weight | 270.28 g/mol |
| Molecular Formula | C16H14O4 |
| Exact Mass | 270.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3859noUmjgl |
|---|---|
| Name | 4-(4-Methylphenyl)-7-methyl-3,4-dihydro-pyrano[4,3-B]pyran-2,5-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.089208927 u |
| Formula | C16H14O4 |
| InChI | InChI=1S/C16H14O4/c1-9-3-5-11(6-4-9)12-8-14(17)20-13-7-10(2)19-16(18)15(12)13/h3-7,12H,8H2,1-2H3 |
| InChIKey | WAQVQVJYSNMXTR-UHFFFAOYSA-N |
| SMILES | C12=C(C(CC(O2)=O)C=2C=CC(=CC2)C)C(OC(=C1)C)=O |