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ethyl 2-{4-[(3-{[(4-bromophenyl)sulfonyl]amino}-2-quinoxalinyl)amino]phenyl}-3,3,3-trifluoro-2-hydroxypropanoate
SpectraBase Compound ID 7Ki9cbjkKER
InChI InChI=1S/C25H20BrF3N4O5S/c1-2-38-23(34)24(35,25(27,28)29)15-7-11-17(12-8-15)30-21-22(32-20-6-4-3-5-19(20)31-21)33-39(36,37)18-13-9-16(26)10-14-18/h3-14,35H,2H2,1H3,(H,30,31)(H,32,33)
InChIKey YDGJUENZRLIIMV-UHFFFAOYSA-N
Mol Weight 625.42 g/mol
Molecular Formula C25H20BrF3N4O5S
Exact Mass 624.028988 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3tcFrPxK2Fx
Name ethyl 2-{4-[(3-{[(4-bromophenyl)sulfonyl]amino}-2-quinoxalinyl)amino]phenyl}-3,3,3-trifluoro-2-hydroxypropanoate
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/C25H20BrF3N4O5S/c1-2-38-23(34)24(35,25(27,28)29)15-7-11-17(12-8-15)30-21-22(32-20-6-4-3-5-19(20)31-21)33-39(36,37)18-13-9-16(26)10-14-18/h3-14,35H,2H2,1H3,(H,30,31)(H,32,33)
InChIKey YDGJUENZRLIIMV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_763
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: 602934EXP04Sav000540; Labnumber: 602934EXP04Sav000540; VK_ID: VK-000764
Temperature 308 °C