3-{[3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carboxamido}-6-nitrocoumarin

SpectraBase Compound ID	1HENvKsTaeK
InChI	InChI=1S/C20H11ClFN3O6/c1-9-16(18(24-31-9)17-12(21)3-2-4-13(17)22)19(26)23-14-8-10-7-11(25(28)29)5-6-15(10)30-20(14)27/h2-8H,1H3,(H,23,26)
InChIKey	LJGCPQDGWLUHLN-UHFFFAOYSA-N Google Search
Mol Weight	443.77 g/mol
Molecular Formula	C20H11ClFN3O6
Exact Mass	443.032041 g/mol

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SpectraBase Spectrum ID	3JljPyoFeVH
Name	3-{[3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYL-4-ISOXAZOLYL]CARBOXAMIDO}-6-NITROCOUMARIN
Source of Sample	MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number	BTB 4917
Copyright	Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H11ClFN3O6
InChI	InChI=1S/C20H11ClFN3O6/c1-9-16(18(24-31-9)17-12(21)3-2-4-13(17)22)19(26)23-14-8-10-7-11(25(28)29)5-6-15(10)30-20(14)27/h2-8H,1H3,(H,23,26)
InChIKey	LJGCPQDGWLUHLN-UHFFFAOYSA-N
Melting Point	217-219C
Molecular Weight	443.773010
Synonyms	COUMARIN, 3-//3-/2-CHLORO-6-FLUORO- PHENYL/-5-METHYL-4-ISOXAZOLYL/CARBOX- AMIDO/-6-NITRO-,
Technique	KBr WAFER