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{[3-(2,6-dichlorobenzyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid, o-chlorophenacyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

{[3-(2,6-dichlorobenzyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid, o-chlorophenacyl ester
SpectraBase Compound ID KliI5xcymgX
InChI InChI=1S/C27H19Cl3O6/c1-15-17-10-9-16(34-14-26(32)35-13-24(31)18-5-2-3-6-21(18)28)11-25(17)36-27(33)19(15)12-20-22(29)7-4-8-23(20)30/h2-11H,12-14H2,1H3
InChIKey KBXKGNQBDLLNJF-UHFFFAOYSA-N
Mol Weight 545.8 g/mol
Molecular Formula C27H19Cl3O6
Exact Mass 544.024721 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 149eH5mP1H8
Name {[3-(2,6-dichlorobenzyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetic acid, o-chlorophenacyl ester
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H19Cl3O6
InChI InChI=1S/C27H19Cl3O6/c1-15-17-10-9-16(34-14-26(32)35-13-24(31)18-5-2-3-6-21(18)28)11-25(17)36-27(33)19(15)12-20-22(29)7-4-8-23(20)30/h2-11H,12-14H2,1H3
InChIKey KBXKGNQBDLLNJF-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 56716M
Solvent CDCl3