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{[2-(2-PYRIDYL)-6-(TRIFLUOROMETHYL)-4-PYRIMIDINYL]THIO}ACETIC ACID, METHYL ESTER
SpectraBase Compound ID EAeUTo3tlhj
InChI InChI=1S/C13H10F3N3O2S/c1-21-11(20)7-22-10-6-9(13(14,15)16)18-12(19-10)8-4-2-3-5-17-8/h2-6H,7H2,1H3
InChIKey UGMLAKAURKMFCH-UHFFFAOYSA-N
Mol Weight 329.3 g/mol
Molecular Formula C13H10F3N3O2S
Exact Mass 329.044582 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EAXK4IXMdXl
Name {[2-(2-PYRIDYL)-6-(TRIFLUOROMETHYL)-4-PYRIMIDINYL]THIO}ACETIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10F3N3O2S
InChI InChI=1S/C13H10F3N3O2S/c1-21-11(20)7-22-10-6-9(13(14,15)16)18-12(19-10)8-4-2-3-5-17-8/h2-6H,7H2,1H3
InChIKey UGMLAKAURKMFCH-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 92-94C
Molecular Weight 329.30
Solvent CDCl3; Reference=TMS; Temperature 297K