For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Benzamide, N-(4-bromo-3-phenyl-1H-pyrazol-5-yl)-3,4-dimethoxy-

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

Benzamide, N-(4-bromo-3-phenyl-1H-pyrazol-5-yl)-3,4-dimethoxy-
SpectraBase Compound ID 2YPvGfIVfQl
InChI InChI=1S/C18H16BrN3O3/c1-24-13-9-8-12(10-14(13)25-2)18(23)20-17-15(19)16(21-22-17)11-6-4-3-5-7-11/h3-10H,1-2H3,(H2,20,21,22,23)
InChIKey MIZJZWIWOKMMPD-UHFFFAOYSA-N
Mol Weight 402.25 g/mol
Molecular Formula C18H16BrN3O3
Exact Mass 401.037504 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ez3dPYma4nA
Name Benzamide, N-(4-bromo-3-phenyl-1H-pyrazol-5-yl)-3,4-dimethoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.037504384 u
Formula C18H16BrN3O3
InChI InChI=1S/C18H16BrN3O3/c1-24-13-9-8-12(10-14(13)25-2)18(23)20-17-15(19)16(21-22-17)11-6-4-3-5-7-11/h3-10H,1-2H3,(H2,20,21,22,23)
InChIKey MIZJZWIWOKMMPD-UHFFFAOYSA-N
Molecular Weight 402.248 g/mol
SMILES COC1=CC(=CC=C1OC)C(NC1=C(C(=NN1)C1=CC=CC=C1)Br)=O