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4-(2-hydroxyethyl)-2-[4-isopropyl-6-(trifluoromethyl)pyrimidin-2-yl]-5-methyl-1H-pyrazol-3-one
SpectraBase Compound ID CRjaTQ27gKK
InChI InChI=1S/C14H17F3N4O2/c1-7(2)10-6-11(14(15,16)17)19-13(18-10)21-12(23)9(4-5-22)8(3)20-21/h6-7,20,22H,4-5H2,1-3H3
InChIKey VPKBUMMWXODYJT-UHFFFAOYSA-N
Mol Weight 330.31 g/mol
Molecular Formula C14H17F3N4O2
Exact Mass 330.13036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XuSP8o48cz
Name 4-(2-hydroxyethyl)-2-[4-isopropyl-6-(trifluoromethyl)pyrimidin-2-yl]-5-methyl-1H-pyrazol-3-one
Alternate Name(s) 4-(2-hydroxyethyl)-2-[4-isopropyl-6-(trifluoromethyl)pyrimidin-2-yl]-5-methyl-3-pyrazolin-3-one 4-(2-hydroxyethyl)-5-methyl-2-[4-propan-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]-1H-pyrazol-3-one 4-(2-hydroxyethyl)-5-methyl-2-[4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17F3N4O2
InChI InChI=1S/C14H17F3N4O2/c1-7(2)10-6-11(14(15,16)17)19-13(18-10)21-12(23)9(4-5-22)8(3)20-21/h6-7,20,22H,4-5H2,1-3H3
InChIKey VPKBUMMWXODYJT-UHFFFAOYSA-N
Molecular Weight 330.311 g/mol
SMILES N1C(=C(CCO)C(N1c1nc(cc(n1)C(F)(F)F)C(C)C)=O)C
SPLASH splash10-0002-0093000000-174eb19b378550acf7bd
Source of Spectrum C5-2005-811-3
Wiley ID 1618240