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5-(2-PROPEN-1-YL)-6-(TRIFLUOROMETHYL)-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 5o8mRPxXNL
InChI InChI=1S/C8H7F3N2O/c1-2-3-5-6(8(9,10)11)12-4-13-7(5)14/h2,4H,1,3H2,(H,12,13,14)
InChIKey DKBXKVCIHWHYQI-UHFFFAOYSA-N
Mol Weight 204.15 g/mol
Molecular Formula C8H7F3N2O
Exact Mass 204.051047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5OiG3BwYU2p
Name 5-(2-PROPEN-1-YL)-6-(TRIFLUOROMETHYL)-PYRIMIDIN-4(3H)-ONE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7F3N2O
InChI InChI=1S/C8H7F3N2O/c1-2-3-5-6(8(9,10)11)12-4-13-7(5)14/h2,4H,1,3H2,(H,12,13,14)
InChIKey DKBXKVCIHWHYQI-UHFFFAOYSA-N
Literature Reference Author J.DREXLER,U.GROTH
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6314(2014)
Literature Reference DOI 10.1002/ejoc.201402755
Molecular Weight 204.152 g/mol
Solvent CDCl3
Source File Reference UWIR19234