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3-(p-fluorobenzyl)-7-hydroxy-4-methylcoumarin, O-ester with O,O-diethyl phosphorothioate

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

3-(p-fluorobenzyl)-7-hydroxy-4-methylcoumarin, O-ester with O,O-diethyl phosphorothioate
SpectraBase Compound ID 19vhWAkBqqu
InChI InChI=1S/C21H22FO5PS/c1-4-24-28(29,25-5-2)27-17-10-11-18-14(3)19(21(23)26-20(18)13-17)12-15-6-8-16(22)9-7-15/h6-11,13H,4-5,12H2,1-3H3
InChIKey ISSLVRHWXNIMED-UHFFFAOYSA-N
Mol Weight 436.43 g/mol
Molecular Formula C21H22FO5PS
Exact Mass 436.09096 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID F5Ey7XJen06
Name 3-(p-FLUOROBENZYL)-7-HYDROXY-4-METHYLCOUMARIN, O-ESTER WITH O,O-DIETHYL PHOSPHOROTHIOATE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22FO5PS
InChI InChI=1S/C21H22FO5PS/c1-4-24-28(29,25-5-2)27-17-10-11-18-14(3)19(21(23)26-20(18)13-17)12-15-6-8-16(22)9-7-15/h6-11,13H,4-5,12H2,1-3H3
InChIKey ISSLVRHWXNIMED-UHFFFAOYSA-N
Melting Point 88-90C
Molecular Weight 436.44
Technique KBr WAFER