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N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
SpectraBase Compound ID K0tEZCMtKK4
InChI InChI=1S/C25H21BrN6O/c1-16-12-22(23-17(2)30-32(24(23)28-16)21-6-4-3-5-7-21)25(33)29-20-10-8-18(9-11-20)14-31-15-19(26)13-27-31/h3-13,15H,14H2,1-2H3,(H,29,33)
InChIKey QXLXEUGLYPTSMG-UHFFFAOYSA-N
Mol Weight 501.39 g/mol
Molecular Formula C25H21BrN6O
Exact Mass 500.096022 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CeYwH4vS08Q
Name N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}-3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
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/C25H21BrN6O/c1-16-12-22(23-17(2)30-32(24(23)28-16)21-6-4-3-5-7-21)25(33)29-20-10-8-18(9-11-20)14-31-15-19(26)13-27-31/h3-13,15H,14H2,1-2H3,(H,29,33)
InChIKey QXLXEUGLYPTSMG-UHFFFAOYSA-N
NMR Offset 17.913
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31398
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: 1809307; SBI_ID: SBI-031402
Temperature 303 °C