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N-[3-(1H-Imidazol-1-yl)propyl]-3-(trifluoromethyl)benzamide

View entire compound with spectra: 1 NMR

N-[3-(1H-Imidazol-1-yl)propyl]-3-(trifluoromethyl)benzamide
SpectraBase Compound ID FVL4Zlqer49
InChI InChI=1S/C14H14F3N3O/c15-14(16,17)12-4-1-3-11(9-12)13(21)19-5-2-7-20-8-6-18-10-20/h1,3-4,6,8-10H,2,5,7H2,(H,19,21)
InChIKey KMAJKZQFGGERQR-UHFFFAOYSA-N
Mol Weight 297.28 g/mol
Molecular Formula C14H14F3N3O
Exact Mass 297.108897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CYdigznKw3R
Name N-[3-(1H-Imidazol-1-yl)propyl]-3-(trifluoromethyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 297.108896571 u
Formula C14H14F3N3O
InChI InChI=1S/C14H14F3N3O/c15-14(16,17)12-4-1-3-11(9-12)13(21)19-5-2-7-20-8-6-18-10-20/h1,3-4,6,8-10H,2,5,7H2,(H,19,21)
InChIKey KMAJKZQFGGERQR-UHFFFAOYSA-N
Molecular Weight 297.281 g/mol
SMILES C(NCCCN1C=CN=C1)(=O)C1=CC(C(F)(F)F)=CC=C1