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4-TRIFLUOROMETHYL-6-METHYL-PYRIMIDIN-2-ONE
SpectraBase Compound ID 95VdfQ229RY
InChI InChI=1S/C6H5F3N2O/c1-3-2-4(6(7,8)9)11-5(12)10-3/h2H,1H3,(H,10,11,12)
InChIKey JOJJVSVFFPOKMJ-UHFFFAOYSA-N
Mol Weight 178.11 g/mol
Molecular Formula C6H5F3N2O
Exact Mass 178.035397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bpr7BSFBkwr
Name 4-Methyl-6-(trifluoromethyl)-2-pyrimidinol
Alternate Name(s) 2-Pyrimidinol, 4-methyl-6-(trifluoromethyl)- 6-Methyl-4-(trifluoromethyl)-1H-pyrimidin-2-one 4-Methyl-6-(trifluoromethyl)pyrimidin-2-ol
CAS Registry Number 104048-92-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5F3N2O
InChI InChI=1S/C6H5F3N2O/c1-3-2-4(6(7,8)9)11-5(12)10-3/h2H,1H3,(H,10,11,12)
InChIKey JOJJVSVFFPOKMJ-UHFFFAOYSA-N
Molecular Weight 178.114 g/mol
SMILES Oc1nc(C(F)(F)F)cc(n1)C
SPLASH splash10-07do-9700000000-9778e48cc3974bf9859a
Source of Spectrum IY-2-4893-1
Wiley ID 1656914