For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
{[2-(2-PYRIDYL)-6-(TRIFLUOROMETHYL)-4-PYRIMIDINYL]THIO}ACETIC ACID, ETHYL ESTER
SpectraBase Compound ID 8LOK7VZ1Hrt
InChI InChI=1S/C14H12F3N3O2S/c1-2-22-12(21)8-23-11-7-10(14(15,16)17)19-13(20-11)9-5-3-4-6-18-9/h3-7H,2,8H2,1H3
InChIKey TWAZXSRZEIDUIP-UHFFFAOYSA-N
Mol Weight 343.32 g/mol
Molecular Formula C14H12F3N3O2S
Exact Mass 343.060232 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EdwMbDyAMKx
Name {[2-(2-PYRIDYL)-6-(TRIFLUOROMETHYL)-4-PYRIMIDINYL]THIO}ACETIC ACID, ETHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12F3N3O2S
InChI InChI=1S/C14H12F3N3O2S/c1-2-22-12(21)8-23-11-7-10(14(15,16)17)19-13(20-11)9-5-3-4-6-18-9/h3-7H,2,8H2,1H3
InChIKey TWAZXSRZEIDUIP-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 128-129C
Molecular Weight 343.33
Solvent CDCl3; Reference=TMS; Temperature 297K