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

*Links on SpectraBase are not permalinks.
CIS-4,6-BIS-(HYDROXY)-4,6-BIS-(TRIFLUOROMETHYL)-HEXAHYDRO-PYRIMIDIN-2-THIONE;MAJOR-ISOMER
SpectraBase Compound ID 7tY9oSLblBt
InChI InChI=1S/C6H6F6N2O2S/c7-5(8,9)3(15)1-4(16,6(10,11)12)14-2(17)13-3/h15-16H,1H2,(H2,13,14,17)/t3-,4-/m1/s1
InChIKey KTMKCFQWNNBDGJ-QWWZWVQMSA-N
Mol Weight 284.18 g/mol
Molecular Formula C6H6F6N2O2S
Exact Mass 284.005418 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F 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 8OyPl0zN155
Name CIS-4,6-BIS-(HYDROXY)-4,6-BIS-(TRIFLUOROMETHYL)-HEXAHYDRO-PYRIMIDIN-2-THIONE;MAJOR-ISOMER
Compound Number IIIB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H6F6N2O2S
InChI InChI=1S/C6H6F6N2O2S/c7-5(8,9)3(15)1-4(16,6(10,11)12)14-2(17)13-3/h15-16H,1H2,(H2,13,14,17)/t3-,4-/m1/s1
InChIKey KTMKCFQWNNBDGJ-QWWZWVQMSA-N
Literature Reference Author Y.V.BURGART,O.G.KUZUEVA,M.V.PRYADEINA,C.O.KAPPE,V.I.SALOUTIN
Literature Reference Citation RUSS.J.ORG.CHEM.,37,869(2001)
Literature Reference DOI 10.1023/A:1012473901354
Solvent C6F6
Source File Reference UWVN5509