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2-(4-Chloro-2-fluorophenyl)-4-(4-(trifluoromethyl)phenyl)pyrimidine
SpectraBase Compound ID JmRsmJLtKTp
InChI InChI=1S/C17H9ClF4N2/c18-12-5-6-13(14(19)9-12)16-23-8-7-15(24-16)10-1-3-11(4-2-10)17(20,21)22/h1-9H
InChIKey UKUFOKPMMZRXQK-UHFFFAOYSA-N
Mol Weight 352.72 g/mol
Molecular Formula C17H9ClF4N2
Exact Mass 352.039039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4AUghClGUg
Name 2-(4-chloro-2-fluorophenyl)-4-(4-(trifluoromethyl)phenyl)pyrimidine
Appearance White solid
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Exact Mass 352.039038650 u
Formula C17H9ClF4N2
InChI InChI=1S/C17H9ClF4N2/c18-12-5-6-13(14(19)9-12)16-23-8-7-15(24-16)10-1-3-11(4-2-10)17(20,21)22/h1-9H
InChIKey UKUFOKPMMZRXQK-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500747
Molecular Weight 352.720 g/mol
Quality 29
Reported Formula C17H9ClF4N2
SMILES C1(Cl)=CC(=C(C=C1)C1=NC=CC(=N1)C1=CC=C(C=C1)C(F)(F)F)F
SPLASH splash10-0udi-0409000000-bc96e51afbb3721382c8
Source of Spectrum QE-21-SM20-7d (DOI: 10.1002/chem.201500747)
Wiley ID 1906574