| SpectraBase Compound ID | sA7j7a8P18 |
|---|---|
| InChI | InChI=1S/C25H18Cl2O6/c26-18-11-19-21(20(27)12-18)31-13-25(22(19)28,14-32-23(29)16-7-3-1-4-8-16)15-33-24(30)17-9-5-2-6-10-17/h1-12H,13-15H2 |
| InChIKey | HAYSJBYFPYKJMT-UHFFFAOYSA-N |
| Mol Weight | 485.32 g/mol |
| Molecular Formula | C25H18Cl2O6 |
| Exact Mass | 484.048044 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1MvN6WLxrM8 |
|---|---|
| Name | 3,3-bis(hydroxymethyl)-6,8-dichloro-4-chromanone, dibenzoate (ester) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H18Cl2O6 |
| InChI | InChI=1S/C25H18Cl2O6/c26-18-11-19-21(20(27)12-18)31-13-25(22(19)28,14-32-23(29)16-7-3-1-4-8-16)15-33-24(30)17-9-5-2-6-10-17/h1-12H,13-15H2 |
| InChIKey | HAYSJBYFPYKJMT-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 47310M |
| Solvent | CDCl3 |