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4-(2-hydroxyethyl)-5-methyl-2-[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]-1H-pyrazol-3-one
SpectraBase Compound ID AyMLCbxGVy5
InChI InChI=1S/C12H13F3N4O2/c1-6-5-9(12(13,14)15)17-11(16-6)19-10(21)8(3-4-20)7(2)18-19/h5,18,20H,3-4H2,1-2H3
InChIKey NBDDUIUFHJMJCY-UHFFFAOYSA-N
Mol Weight 302.26 g/mol
Molecular Formula C12H13F3N4O2
Exact Mass 302.09906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IGVFG5TE8Ta
Name 4-(2-hydroxyethyl)-5-methyl-2-[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]-1H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13F3N4O2
InChI InChI=1S/C12H13F3N4O2/c1-6-5-9(12(13,14)15)17-11(16-6)19-10(21)8(3-4-20)7(2)18-19/h5,18,20H,3-4H2,1-2H3
InChIKey NBDDUIUFHJMJCY-UHFFFAOYSA-N
Molecular Weight 302.257 g/mol
SMILES N1C(=C(CCO)C(N1c1nc(cc(n1)C(F)(F)F)C)=O)C
SPLASH splash10-0jbc-9857000000-111c25251730f9cf97b1
Source of Spectrum C5-2005-811-3
Synonyms 4-(2-hydroxyethyl)-5-methyl-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-3-one 4-(2-hydroxyethyl)-5-methyl-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]-3-pyrazolin-3-one
Wiley ID 1618241