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tert-butyl 4-{[6-bromo-2-(4-chlorophenyl)-4-quinolinyl]carbonyl}-1-piperazinecarboxylate
SpectraBase Compound ID LdhpimzYYz1
InChI InChI=1S/C25H25BrClN3O3/c1-25(2,3)33-24(32)30-12-10-29(11-13-30)23(31)20-15-22(16-4-7-18(27)8-5-16)28-21-9-6-17(26)14-19(20)21/h4-9,14-15H,10-13H2,1-3H3
InChIKey XVHYLXLBCNUHRR-UHFFFAOYSA-N
Mol Weight 530.85 g/mol
Molecular Formula C25H25BrClN3O3
Exact Mass 529.076782 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LNWXyLxId8x
Name tert-butyl 4-{[6-bromo-2-(4-chlorophenyl)-4-quinolinyl]carbonyl}-1-piperazinecarboxylate
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/C25H25BrClN3O3/c1-25(2,3)33-24(32)30-12-10-29(11-13-30)23(31)20-15-22(16-4-7-18(27)8-5-16)28-21-9-6-17(26)14-19(20)21/h4-9,14-15H,10-13H2,1-3H3
InChIKey XVHYLXLBCNUHRR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14808
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/1020223; UBI_ID: UBI-014811
Temperature 318 °C