| SpectraBase Compound ID | HCododgZrkf |
|---|---|
| InChI | InChI=1S/C13H14O4/c1-15-11-7-3-5-9(13(11)16-2)10-6-4-8-12(14)17-10/h3-5,7-8,10H,6H2,1-2H3/t10-/m0/s1 |
| InChIKey | XKGZNEUFKNFWNE-JTQLQIEISA-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 | JzvfBOI0TZs |
|---|---|
| Name | (S)-6-(2,3-Dimethoxyphenyl)-5,6-dihydropyran-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/c1-15-11-7-3-5-9(13(11)16-2)10-6-4-8-12(14)17-10/h3-5,7-8,10H,6H2,1-2H3/t10-/m0/s1 |
| InChIKey | XKGZNEUFKNFWNE-JTQLQIEISA-N |
| Molecular Weight | 234.251 g/mol |
| SMILES | C=1(C(=C(OC)C=CC1)OC)[C@]1(OC(=O)C=CC1)[H] |