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3-pyridinecarboxamide, 5-bromo-N-[[4-(1,1-dimethylethyl)phenyl]methyl]-
SpectraBase Compound ID 7yOx4n12rLw
InChI InChI=1S/C17H19BrN2O/c1-17(2,3)14-6-4-12(5-7-14)9-20-16(21)13-8-15(18)11-19-10-13/h4-8,10-11H,9H2,1-3H3,(H,20,21)
InChIKey QESOVBVRKHHPQJ-UHFFFAOYSA-N
Mol Weight 347.26 g/mol
Molecular Formula C17H19BrN2O
Exact Mass 346.068076 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 69uQmtSozbr
Name 3-pyridinecarboxamide, 5-bromo-N-[[4-(1,1-dimethylethyl)phenyl]methyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H19BrN2O/c1-17(2,3)14-6-4-12(5-7-14)9-20-16(21)13-8-15(18)11-19-10-13/h4-8,10-11H,9H2,1-3H3,(H,20,21)
InChIKey QESOVBVRKHHPQJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_366
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11222289; Labnumber: LP-2110322