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Nicotinamide, 2-benzylamino-N-(3-fluorophenyl)-

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Nicotinamide, 2-benzylamino-N-(3-fluorophenyl)-
SpectraBase Compound ID 3mIC0NlHAUE
InChI InChI=1S/C19H16FN3O/c20-15-8-4-9-16(12-15)23-19(24)17-10-5-11-21-18(17)22-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,21,22)(H,23,24)
InChIKey GGSQTTRTZBXBBP-UHFFFAOYSA-N
Mol Weight 321.36 g/mol
Molecular Formula C19H16FN3O
Exact Mass 321.12774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3n8kmLnkgbD
Name Nicotinamide, 2-benzylamino-N-(3-fluorophenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.127740309 u
Formula C19H16FN3O
InChI InChI=1S/C19H16FN3O/c20-15-8-4-9-16(12-15)23-19(24)17-10-5-11-21-18(17)22-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,21,22)(H,23,24)
InChIKey GGSQTTRTZBXBBP-UHFFFAOYSA-N
Molecular Weight 321.355 g/mol
SMILES C(C1=C(NCC2=CC=CC=C2)N=CC=C1)(NC1=CC(F)=CC=C1)=O