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6-bromo-4-{[4-(2,3-dimethylphenyl)-1-piperazinyl]carbonyl}-2-(5-ethyl-2-thienyl)quinoline
SpectraBase Compound ID 8rKlcpxFYGm
InChI InChI=1S/C28H28BrN3OS/c1-4-21-9-11-27(34-21)25-17-23(22-16-20(29)8-10-24(22)30-25)28(33)32-14-12-31(13-15-32)26-7-5-6-18(2)19(26)3/h5-11,16-17H,4,12-15H2,1-3H3
InChIKey ATFHOJAYYOIFRJ-UHFFFAOYSA-N
Mol Weight 534.52 g/mol
Molecular Formula C28H28BrN3OS
Exact Mass 533.113647 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FAPrgboryrk
Name 6-bromo-4-{[4-(2,3-dimethylphenyl)-1-piperazinyl]carbonyl}-2-(5-ethyl-2-thienyl)quinoline
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/C28H28BrN3OS/c1-4-21-9-11-27(34-21)25-17-23(22-16-20(29)8-10-24(22)30-25)28(33)32-14-12-31(13-15-32)26-7-5-6-18(2)19(26)3/h5-11,16-17H,4,12-15H2,1-3H3
InChIKey ATFHOJAYYOIFRJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7114
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: UZI/1266280; Labnumber: COL4179; UZI_ID: UZI-007116
Temperature 318 °C