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4-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-(5-bromo-2-pyridinyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
SpectraBase Compound ID HBdgAG3y2l5
InChI InChI=1S/C30H26Br2ClN3O4/c1-16-27(30(38)36-26-11-7-19(31)14-34-26)28(29-22(35-16)4-3-5-23(29)37)17-6-9-24(39-2)18(12-17)15-40-25-10-8-20(33)13-21(25)32/h6-14,28,35H,3-5,15H2,1-2H3,(H,34,36,38)
InChIKey DRKGLZVVLXKDQS-UHFFFAOYSA-N
Mol Weight 687.82 g/mol
Molecular Formula C30H26Br2ClN3O4
Exact Mass 684.99786 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AwiGDCNIOWO
Name 4-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-(5-bromo-2-pyridinyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
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/C30H26Br2ClN3O4/c1-16-27(30(38)36-26-11-7-19(31)14-34-26)28(29-22(35-16)4-3-5-23(29)37)17-6-9-24(39-2)18(12-17)15-40-25-10-8-20(33)13-21(25)32/h6-14,28,35H,3-5,15H2,1-2H3,(H,34,36,38)
InChIKey DRKGLZVVLXKDQS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13560
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/9143132; UBI_ID: UBI-013563
Temperature 318 °C