| SpectraBase Compound ID | HzlsC4yfssu |
|---|---|
| InChI | InChI=1S/C16H20O3/c1-2-3-4-5-6-11-18-14-9-7-13-8-10-16(17)19-15(13)12-14/h7-10,12H,2-6,11H2,1H3 |
| InChIKey | VBQRBYPEPCLADT-UHFFFAOYSA-N |
| Mol Weight | 260.33 g/mol |
| Molecular Formula | C16H20O3 |
| Exact Mass | 260.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9tA40fAkslr |
|---|---|
| Name | 7-Heptoxy-1-benzopyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.141244501 u |
| Formula | C16H20O3 |
| InChI | InChI=1S/C16H20O3/c1-2-3-4-5-6-11-18-14-9-7-13-8-10-16(17)19-15(13)12-14/h7-10,12H,2-6,11H2,1H3 |
| InChIKey | VBQRBYPEPCLADT-UHFFFAOYSA-N |
| Molecular Weight | 260.333 g/mol |
| SMILES | C1=2OC(C=CC2C=CC(=C1)OCCCCCCC)=O |