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N-(1-Cyano-1,2-dimethyl-propyl)-2-(4-fluoro-phenoxy)-nicotinamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(1-Cyano-1,2-dimethyl-propyl)-2-(4-fluoro-phenoxy)-nicotinamide
SpectraBase Compound ID 849iLAbN4QA
InChI InChI=1S/C18H18FN3O2/c1-12(2)18(3,11-20)22-16(23)15-5-4-10-21-17(15)24-14-8-6-13(19)7-9-14/h4-10,12H,1-3H3,(H,22,23)
InChIKey LWRWSYCUCVJQQG-UHFFFAOYSA-N
Mol Weight 327.36 g/mol
Molecular Formula C18H18FN3O2
Exact Mass 327.138305 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5s41LITZ6xz
Name 3-pyridinecarboxamide, N-(1-cyano-1,2-dimethylpropyl)-2-(4-fluorophenoxy)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.138304993 u
Formula C18H18FN3O2
InChI InChI=1S/C18H18FN3O2/c1-12(2)18(3,11-20)22-16(23)15-5-4-10-21-17(15)24-14-8-6-13(19)7-9-14/h4-10,12H,1-3H3,(H,22,23)
InChIKey LWRWSYCUCVJQQG-UHFFFAOYSA-N
Molecular Weight 327.359 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17360
Solvent DMSO-d6
Source Vendor ID: NMR/10322985; Lab Info: KE; Lab Number: KE-0000030