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4-Trifluoromethyl-5-methyl-6-(4-chlorophenyl)-2-acetylaminopyrimidine
SpectraBase Compound ID KK6sL1asvdy
InChI InChI=1S/C14H11ClF3N3O/c1-7-11(9-3-5-10(15)6-4-9)20-13(19-8(2)22)21-12(7)14(16,17)18/h3-6H,1-2H3,(H,19,20,21,22)
InChIKey XGVQISOITDZTAX-UHFFFAOYSA-N
Mol Weight 329.71 g/mol
Molecular Formula C14H11ClF3N3O
Exact Mass 329.054274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jEp9RtbJPi
Name 4-Trifluoromethyl-5-methyl-6-(4-chlorophenyl)-2-acetylaminopyrimidine
Alternate Name(s) N-[4-(4-chlorophenyl)-5-methyl-6-(trifluoromethyl)-2-pyrimidinyl]acetamide N-[4-(4-chlorophenyl)-5-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethanamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11ClF3N3O
InChI InChI=1S/C14H11ClF3N3O/c1-7-11(9-3-5-10(15)6-4-9)20-13(19-8(2)22)21-12(7)14(16,17)18/h3-6H,1-2H3,(H,19,20,21,22)
InChIKey XGVQISOITDZTAX-UHFFFAOYSA-N
Molecular Weight 329.710 g/mol
SMILES N(c1nc(C(F)(F)F)c(c(n1)-c1ccc(cc1)Cl)C)C(=O)C
SPLASH splash10-000i-0093000000-c69c5eb89491365f50c4
Source of Spectrum Y-45-485-3i
Wiley ID 1711069