| SpectraBase Compound ID | FmF90sZnmDl |
|---|---|
| InChI | InChI=1S/C16H18O4/c1-3-4-5-8-19-16(18)15-10-13(17)12-9-11(2)6-7-14(12)20-15/h6-7,9-10H,3-5,8H2,1-2H3 |
| InChIKey | WPZKPQVUSJIHEE-UHFFFAOYSA-N |
| Mol Weight | 274.32 g/mol |
| Molecular Formula | C16H18O4 |
| Exact Mass | 274.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JxusORGpEj |
|---|---|
| Name | 6-Methyl-4-chromone-2-carboxylic acid, N-pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.120509056 u |
| Formula | C16H18O4 |
| InChI | InChI=1S/C16H18O4/c1-3-4-5-8-19-16(18)15-10-13(17)12-9-11(2)6-7-14(12)20-15/h6-7,9-10H,3-5,8H2,1-2H3 |
| InChIKey | WPZKPQVUSJIHEE-UHFFFAOYSA-N |
| SMILES | C1=CC=2OC(C(OCCCCC)=O)=CC(C2C=C1C)=O |