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4(1H)-Pyrimidinone, 6-methyl-2-(trifluoromethyl)-
SpectraBase Compound ID JhWZ8e9NSvK
InChI InChI=1S/C6H5F3N2O/c1-3-2-4(12)11-5(10-3)6(7,8)9/h2H,1H3,(H,10,11,12)
InChIKey UCULFLJNPKTZFE-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 CkMfzf10684
Name 4(1H)-Pyrimidinone, 6-methyl-2-(trifluoromethyl)-
CAS Registry Number 2557-79-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5F3N2O
InChI InChI=1S/C6H5F3N2O/c1-3-2-4(12)11-5(10-3)6(7,8)9/h2H,1H3,(H,10,11,12)
InChIKey UCULFLJNPKTZFE-UHFFFAOYSA-N
Molecular Weight 178.114 g/mol
SMILES Oc1cc(nc(C(F)(F)F)n1)C
SPLASH splash10-00or-9800000000-546e0553b03f75b20786
Source of Spectrum TA-0-79-0
Synonyms 6-Methyl-2-(trifluoromethyl)-4(1H)-pyrimidinone 4-Pyrimidinol, 6-methyl-2-(trifluoromethyl)- 6-Methyl-2-(trifluoromethyl)-1H-pyrimidin-4-one
Wiley ID 17417