| SpectraBase Compound ID | IkrMYiBwBkC |
|---|---|
| InChI | InChI=1S/C26H18Cl3FO4/c1-2-4-16-17-10-8-15(33-25(31)18-9-7-14(27)11-22(18)29)12-24(17)34-26(32)19(16)13-20-21(28)5-3-6-23(20)30/h3,5-12H,2,4,13H2,1H3 |
| InChIKey | MACVBNHIMUQCQA-UHFFFAOYSA-N |
| Mol Weight | 519.78 g/mol |
| Molecular Formula | C26H18Cl3FO4 |
| Exact Mass | 518.02547 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3V7vB1dOB3A |
|---|---|
| Name | 3-(2-chloro-6-fluorobenzyl)-7-hydroxy-4-propylcoumarin, 2,4-dichlorobenzoate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H18Cl3FO4 |
| InChI | InChI=1S/C26H18Cl3FO4/c1-2-4-16-17-10-8-15(33-25(31)18-9-7-14(27)11-22(18)29)12-24(17)34-26(32)19(16)13-20-21(28)5-3-6-23(20)30/h3,5-12H,2,4,13H2,1H3 |
| InChIKey | MACVBNHIMUQCQA-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57023M |
| Solvent | CDCl3 |