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p-tert-butyl-N-{6-[(3-pyridyl)oxy]-3-pyridyl}benzamide

View entire compound with spectra: 3 NMR, and 1 FTIR

p-tert-butyl-N-{6-[(3-pyridyl)oxy]-3-pyridyl}benzamide
SpectraBase Compound ID J7xhMZme7sx
InChI InChI=1S/C21H21N3O2/c1-21(2,3)16-8-6-15(7-9-16)20(25)24-17-10-11-19(23-13-17)26-18-5-4-12-22-14-18/h4-14H,1-3H3,(H,24,25)
InChIKey MVTVYHFGARENKA-UHFFFAOYSA-N
Mol Weight 347.42 g/mol
Molecular Formula C21H21N3O2
Exact Mass 347.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ArTmwHn5oya
Name p-Tert-butyl-N-{6-[(3-pyridyl)oxy]-3-pyridyl}benzamide
Comments Computed using HOSE algorithm
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Exact Mass 347.163376926 u
Formula C21H21N3O2
InChI InChI=1S/C21H21N3O2/c1-21(2,3)16-8-6-15(7-9-16)20(25)24-17-10-11-19(23-13-17)26-18-5-4-12-22-14-18/h4-14H,1-3H3,(H,24,25)
InChIKey MVTVYHFGARENKA-UHFFFAOYSA-N
Molecular Weight 347.418 g/mol
SMILES N(C(C1=CC=C(C=C1)C(C)(C)C)=O)C=1C=CC(=NC1)OC=1C=NC=CC1