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3-(2-Chloro-6-fluorobenzyl)-7-hydroxy-4-propylcoumarin, o-chlorobenzoate

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

3-(2-Chloro-6-fluorobenzyl)-7-hydroxy-4-propylcoumarin, o-chlorobenzoate
SpectraBase Compound ID 38MH8EkI3Sy
InChI InChI=1S/C26H19Cl2FO4/c1-2-6-16-17-12-11-15(32-25(30)18-7-3-4-8-21(18)27)13-24(17)33-26(31)19(16)14-20-22(28)9-5-10-23(20)29/h3-5,7-13H,2,6,14H2,1H3
InChIKey DQPVOSZESBUUDB-UHFFFAOYSA-N
Mol Weight 485.34 g/mol
Molecular Formula C26H19Cl2FO4
Exact Mass 484.064443 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AtfpmfDDG3z
Name 3-(2-CHLORO-6-FLUOROBENZYL)-7-HYDROXY-4-PROPYLCOUMARIN, o-CHLOROBENZOATE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H19Cl2FO4
InChI InChI=1S/C26H19Cl2FO4/c1-2-6-16-17-12-11-15(32-25(30)18-7-3-4-8-21(18)27)13-24(17)33-26(31)19(16)14-20-22(28)9-5-10-23(20)29/h3-5,7-13H,2,6,14H2,1H3
InChIKey DQPVOSZESBUUDB-UHFFFAOYSA-N
Melting Point 123-125C
Molecular Weight 485.34
Technique KBr WAFER