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N-Cyclohexyl-3-(4-(trifluoromethyl)phenyl)pyrazine-2-carboxamide
SpectraBase Compound ID G2D6ZPI7Olm
InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-8-6-12(7-9-13)15-16(23-11-10-22-15)17(25)24-14-4-2-1-3-5-14/h6-11,14H,1-5H2,(H,24,25)
InChIKey TUHXIZPMTQAXRZ-UHFFFAOYSA-N
Mol Weight 349.36 g/mol
Molecular Formula C18H18F3N3O
Exact Mass 349.140197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID opEr0Fc58o
Name N-Cyclohexyl-3-(4-(trifluoromethyl)phenyl)pyrazine-2-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 349.140196700 u
Formula C18H18F3N3O
InChI InChI=1S/C18H18F3N3O/c19-18(20,21)13-8-6-12(7-9-13)15-16(23-11-10-22-15)17(25)24-14-4-2-1-3-5-14/h6-11,14H,1-5H2,(H,24,25)
InChIKey TUHXIZPMTQAXRZ-UHFFFAOYSA-N
Molecular Weight 349.357 g/mol
SMILES C1(=C(N=CC=N1)C1=CC=C(C=C1)C(F)(F)F)C(=O)NC1CCCCC1