| SpectraBase Compound ID | DW9E3D36CiZ |
|---|---|
| InChI | InChI=1S/C16H14O4/c1-20-16-9-5-3-7-12(16)15(19)10-14(18)11-6-2-4-8-13(11)17/h2-9,17H,10H2,1H3 |
| InChIKey | WAFSMRXEMLPHRQ-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 | DHrldRRVdtz |
|---|---|
| Name | 1-(2-Hydroxyphenyl)-3-(2-methoxyphenyl)propane-1,3-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/c1-20-16-9-5-3-7-12(16)15(19)10-14(18)11-6-2-4-8-13(11)17/h2-9,17H,10H2,1H3 |
| InChIKey | WAFSMRXEMLPHRQ-UHFFFAOYSA-N |
| SMILES | C1=C(C(C(CC(C=2C=CC=CC2OC)=O)=O)=CC=C1)O |