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3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarbothioic acid, S-[(p-fluoroanilino)methyl]ester

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3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarbothioic acid, S-[(p-fluoroanilino)methyl]ester
SpectraBase Compound ID FMSzTDjrAKQ
InChI InChI=1S/C18H13Cl2FN2O2S/c1-10-15(17(23-25-10)16-13(19)3-2-4-14(16)20)18(24)26-9-22-12-7-5-11(21)6-8-12/h2-8,22H,9H2,1H3
InChIKey CDRNMQGQGYCAJI-UHFFFAOYSA-N
Mol Weight 411.28 g/mol
Molecular Formula C18H13Cl2FN2O2S
Exact Mass 410.005882 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1YYGMlMaipE
Name 3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLECARBOTHIOIC ACID,S-[(p-FLUOROANILINO)METHYL]ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13Cl2FN2O2S
InChI InChI=1S/C18H13Cl2FN2O2S/c1-10-15(17(23-25-10)16-13(19)3-2-4-14(16)20)18(24)26-9-22-12-7-5-11(21)6-8-12/h2-8,22H,9H2,1H3
InChIKey CDRNMQGQGYCAJI-UHFFFAOYSA-N
Molecular Weight 411.28
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 4-ISOXAZOLECARBOTHIOIC ACID, 3-/2,6-DICHLOROPHENYL/-5-METHYL-, S-//P-FLUOROANILINO/METHYL/ ESTER