| SpectraBase Compound ID | GiO1iSTvBLJ |
|---|---|
| InChI | InChI=1S/C16H18O5/c1-5-19-16(18)11(4)20-12-6-7-13-9(2)10(3)15(17)21-14(13)8-12/h6-8,11H,5H2,1-4H3 |
| InChIKey | NJVGLBRHZLKKAW-UHFFFAOYSA-N |
| Mol Weight | 290.31 g/mol |
| Molecular Formula | C16H18O5 |
| Exact Mass | 290.115424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | tmwJSLJVYI |
|---|---|
| Name | 2-(3,4-Dimethyl-2-oxo-2H-chromen-7-yloxy)-propionic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.115423675 u |
| Formula | C16H18O5 |
| InChI | InChI=1S/C16H18O5/c1-5-19-16(18)11(4)20-12-6-7-13-9(2)10(3)15(17)21-14(13)8-12/h6-8,11H,5H2,1-4H3 |
| InChIKey | NJVGLBRHZLKKAW-UHFFFAOYSA-N |
| SMILES | C1(C(=C(C)C=2C(O1)=CC(OC(C(=O)OCC)C)=CC2)C)=O |