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

*Links on SpectraBase are not permalinks.
4-[2-(4-METHYLPHENYL)-THIAZOL-4-YLMETHYL]-2,2-BIS-(TRIFLUOROMETHYL)-1,3-OXATHIOLAN-5-ONE
SpectraBase Compound ID GmNtOUBwCBC
InChI InChI=1S/C16H11F6NO2S2/c1-8-2-4-9(5-3-8)12-23-10(7-26-12)6-11-13(24)25-14(27-11,15(17,18)19)16(20,21)22/h2-5,7,11H,6H2,1H3
InChIKey JJMKRWMCBHYJPS-UHFFFAOYSA-N
Mol Weight 427.38 g/mol
Molecular Formula C16H11F6NO2S2
Exact Mass 427.01354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID BqEPPV8BGVT
Name 4-[2-(4-METHYLPHENYL)-THIAZOL-4-YLMETHYL]-2,2-BIS-(TRIFLUOROMETHYL)-1,3-OXATHIOLAN-5-ONE
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11F6NO2S2
InChI InChI=1S/C16H11F6NO2S2/c1-8-2-4-9(5-3-8)12-23-10(7-26-12)6-11-13(24)25-14(27-11,15(17,18)19)16(20,21)22/h2-5,7,11H,6H2,1H3
InChIKey JJMKRWMCBHYJPS-UHFFFAOYSA-N
Literature Reference Author K.PUMPOR,E.WINDEISEN,K.BURGER
Literature Reference Citation J.HETCYCL.CHEM.,40,435(2003)
Literature Reference DOI 10.1002/jhet.5570400306
Molecular Weight 427.379 g/mol
Solvent CDCl3
Source File Reference UWMS22581