| SpectraBase Compound ID | 4QJFxPgZu6L |
|---|---|
| InChI | InChI=1S/C22H26O8/c1-6-7-8-17-12(2)18-9-16(10-27-13(3)23)20(29-15(5)25)19(11-28-14(4)24)21(18)30-22(17)26/h9H,6-8,10-11H2,1-5H3 |
| InChIKey | PMBZGLJOLQKOGS-UHFFFAOYSA-N |
| Mol Weight | 418.44 g/mol |
| Molecular Formula | C22H26O8 |
| Exact Mass | 418.162768 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IFPNprkuUbG |
|---|---|
| Name | 6,8-bis(hydroxymethyl)-3-butyl-7-hydroxy-4-methylcoumarin, triacetate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26O8 |
| InChI | InChI=1S/C22H26O8/c1-6-7-8-17-12(2)18-9-16(10-27-13(3)23)20(29-15(5)25)19(11-28-14(4)24)21(18)30-22(17)26/h9H,6-8,10-11H2,1-5H3 |
| InChIKey | PMBZGLJOLQKOGS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52565M |
| Solvent | CDCl3 |