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4-[3'-(Ethoxycarbonyl)propyl]-7-[(p-fluorobenzoyl)methoxy]-8-methylcoumarin
SpectraBase Compound ID VrzWTKhHOs
InChI InChI=1S/C24H23FO6/c1-3-29-22(27)6-4-5-17-13-23(28)31-24-15(2)21(12-11-19(17)24)30-14-20(26)16-7-9-18(25)10-8-16/h7-13H,3-6,14H2,1-2H3
InChIKey MBQXFDZWISRYKT-UHFFFAOYSA-N
Mol Weight 426.44 g/mol
Molecular Formula C24H23FO6
Exact Mass 426.147867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpVlMnNsBDF
Name 4-[3'-(Ethoxycarbonyl)propyl]-7-[(p-fluorobenzoyl)methoxy]-8-methylcoumarin
Alternate Name(s) Ethyl(7-(2-(4-fluorophenyl)-2-oxoethoxy)-8-methyl-2-oxo-2Hchromen-4-yl)butanoate Ethyl 4-{7-[2-(4-fluorophenyl)-2-oxoethoxy]-8-methyl-2-oxo-2H-chromen-4-yl}butanoate Ethyl 4-(7-(2-(4-fluorophenyl)-2-oxoethoxy)-8-methyl-2-oxo-2H-chromen-4-yl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23FO6
InChI InChI=1S/C24H23FO6/c1-3-29-22(27)6-4-5-17-13-23(28)31-24-15(2)21(12-11-19(17)24)30-14-20(26)16-7-9-18(25)10-8-16/h7-13H,3-6,14H2,1-2H3
InChIKey MBQXFDZWISRYKT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200300741
Molecular Weight 426.440 g/mol
SMILES C(=O)(OCC)CCCC1=CC(Oc2c(c(ccc12)OCC(=O)c1ccc(cc1)F)C)=O
SPLASH splash10-00di-4910000000-3d5888c167f2f870ad98
Source of Spectrum APP-336-277-4l
Wiley ID 1770725