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

*Links on SpectraBase are not permalinks.
4-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
SpectraBase Compound ID FUFVKRatiIz
InChI InChI=1S/C21H20BrN3O2/c1-11-19(12(2)24(23-11)10-13-3-7-16(22)8-4-13)25-20(26)17-14-5-6-15(9-14)18(17)21(25)27/h3-8,14-15,17-18H,9-10H2,1-2H3
InChIKey GMEWGLAWBFPYDJ-UHFFFAOYSA-N
Mol Weight 426.31 g/mol
Molecular Formula C21H20BrN3O2
Exact Mass 425.07389 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID JpeTFdtRZMe
Name 4-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
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/C21H20BrN3O2/c1-11-19(12(2)24(23-11)10-13-3-7-16(22)8-4-13)25-20(26)17-14-5-6-15(9-14)18(17)21(25)27/h3-8,14-15,17-18H,9-10H2,1-2H3
InChIKey GMEWGLAWBFPYDJ-UHFFFAOYSA-N
NMR Offset 17.9122
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_33472
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: 1927513; SBI_ID: SBI-033476
Temperature 303 °C