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3-(p-fluorobenzyl)-7-hydroxy-4-methylcoumarin, 2,5-dimethoxybenzoate

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

3-(p-fluorobenzyl)-7-hydroxy-4-methylcoumarin, 2,5-dimethoxybenzoate
SpectraBase Compound ID 1jIJXMonRA
InChI InChI=1S/C26H21FO6/c1-15-20-10-8-19(32-26(29)22-13-18(30-2)9-11-23(22)31-3)14-24(20)33-25(28)21(15)12-16-4-6-17(27)7-5-16/h4-11,13-14H,12H2,1-3H3
InChIKey SUUSZJDGNDNSBU-UHFFFAOYSA-N
Mol Weight 448.45 g/mol
Molecular Formula C26H21FO6
Exact Mass 448.132217 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H900mzAErX7
Name 3-(p-FLUOROBENZYL)-7-HYDROXY-4-METHYLCOUMARIN, 2,5-DIMETHOXYBENZOATE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21FO6
InChI InChI=1S/C26H21FO6/c1-15-20-10-8-19(32-26(29)22-13-18(30-2)9-11-23(22)31-3)14-24(20)33-25(28)21(15)12-16-4-6-17(27)7-5-16/h4-11,13-14H,12H2,1-3H3
InChIKey SUUSZJDGNDNSBU-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 135-137C
Molecular Weight 448.45
Solvent CDCl3; Reference=TMS; Temperature 297K