| SpectraBase Compound ID | 3QGqUryvUOq |
|---|---|
| InChI | InChI=1S/C15H16O4/c1-10(2)7-8-18-15(17)14-9-12(16)11-5-3-4-6-13(11)19-14/h3-6,9-10H,7-8H2,1-2H3 |
| InChIKey | NPIOICAVVLAYTN-UHFFFAOYSA-N |
| Mol Weight | 260.29 g/mol |
| Molecular Formula | C15H16O4 |
| Exact Mass | 260.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G7me0oY4Ot5 |
|---|---|
| Name | Chromone-2-carboxylic acid, 3-methylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.104858991 u |
| Formula | C15H16O4 |
| InChI | InChI=1S/C15H16O4/c1-10(2)7-8-18-15(17)14-9-12(16)11-5-3-4-6-13(11)19-14/h3-6,9-10H,7-8H2,1-2H3 |
| InChIKey | NPIOICAVVLAYTN-UHFFFAOYSA-N |
| Molecular Weight | 260.289 g/mol |
| SMILES | C1=CC=C2C(=C1)OC(C(OCCC(C)C)=O)=CC2=O |