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3-quinolinecarboxamide, N-(5-bromo-2-pyridinyl)-1,2,5,6,7,8-hexahydro-7,7-dimethyl-2,5-dioxo-1-phenyl-
SpectraBase Compound ID 8ErZiPe5js1
InChI InChI=1S/C23H20BrN3O3/c1-23(2)11-18-16(19(28)12-23)10-17(21(29)26-20-9-8-14(24)13-25-20)22(30)27(18)15-6-4-3-5-7-15/h3-10,13H,11-12H2,1-2H3,(H,25,26,29)
InChIKey OFFAGWFXLOKSPJ-UHFFFAOYSA-N
Mol Weight 466.34 g/mol
Molecular Formula C23H20BrN3O3
Exact Mass 465.068805 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lqe6IWE4UV9
Name 3-quinolinecarboxamide, N-(5-bromo-2-pyridinyl)-1,2,5,6,7,8-hexahydro-7,7-dimethyl-2,5-dioxo-1-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 465.068804513 u
Formula C23H20BrN3O3
InChI InChI=1S/C23H20BrN3O3/c1-23(2)11-18-16(19(28)12-23)10-17(21(29)26-20-9-8-14(24)13-25-20)22(30)27(18)15-6-4-3-5-7-15/h3-10,13H,11-12H2,1-2H3,(H,25,26,29)
InChIKey OFFAGWFXLOKSPJ-UHFFFAOYSA-N
Molecular Weight 466.335 g/mol
NMR Offset 18.3915
NMR Spectrometer Frequency 500.137
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_190
Solvent DMSO-d6
Source Vendor ID: NMR/13228833