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3-bromo-N-{1-methyl-2-[2-(propionylamino)ethyl]-1H-benzimidazol-5-yl}benzamide
SpectraBase Compound ID DA9r8yar4wo
InChI InChI=1S/C20H21BrN4O2/c1-3-19(26)22-10-9-18-24-16-12-15(7-8-17(16)25(18)2)23-20(27)13-5-4-6-14(21)11-13/h4-8,11-12H,3,9-10H2,1-2H3,(H,22,26)(H,23,27)
InChIKey SCIKSSHELYWXRT-UHFFFAOYSA-N
Mol Weight 429.32 g/mol
Molecular Formula C20H21BrN4O2
Exact Mass 428.084789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Y2KF04mzDA
Name 3-bromo-N-{1-methyl-2-[2-(propionylamino)ethyl]-1H-benzimidazol-5-yl}benzamide
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/C20H21BrN4O2/c1-3-19(26)22-10-9-18-24-16-12-15(7-8-17(16)25(18)2)23-20(27)13-5-4-6-14(21)11-13/h4-8,11-12H,3,9-10H2,1-2H3,(H,22,26)(H,23,27)
InChIKey SCIKSSHELYWXRT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35006
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: E82954; SBI_ID: SBI-035010
Temperature 298 °C