![{[3-(2,6-dichlorobenzyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid, phenacyl ester](/api/spectrum/68jJ0Se0KQG/structure.png?h=300&w=458 "{[3-(2,6-dichlorobenzyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid, phenacyl ester")
| SpectraBase Compound ID | Bs3UuOj7Wft |
|---|---|
| InChI | InChI=1S/C27H20Cl2O6/c1-16-19-11-10-18(33-15-26(31)34-14-24(30)17-6-3-2-4-7-17)12-25(19)35-27(32)20(16)13-21-22(28)8-5-9-23(21)29/h2-12H,13-15H2,1H3 |
| InChIKey | BFNVLSGQNKILRR-UHFFFAOYSA-N |
| Mol Weight | 511.36 g/mol |
| Molecular Formula | C27H20Cl2O6 |
| Exact Mass | 510.063694 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68jJ0Se0KQG |
|---|---|
| Name | {[3-(2,6-dichlorobenzyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid, phenacyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H20Cl2O6 |
| InChI | InChI=1S/C27H20Cl2O6/c1-16-19-11-10-18(33-15-26(31)34-14-24(30)17-6-3-2-4-7-17)12-25(19)35-27(32)20(16)13-21-22(28)8-5-9-23(21)29/h2-12H,13-15H2,1H3 |
| InChIKey | BFNVLSGQNKILRR-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56718M |
| Solvent | CDCl3 |