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2-(4-isobutylphenyl)-N-{4-[(4-{[2-(4-isobutylphenyl)propanoyl]amino}phenyl)sulfonyl]phenyl}propanamide
SpectraBase Compound ID BJHcx4MpiiS
InChI InChI=1S/C38H44N2O4S/c1-25(2)23-29-7-11-31(12-8-29)27(5)37(41)39-33-15-19-35(20-16-33)45(43,44)36-21-17-34(18-22-36)40-38(42)28(6)32-13-9-30(10-14-32)24-26(3)4/h7-22,25-28H,23-24H2,1-6H3,(H,39,41)(H,40,42)
InChIKey VZCBCUSSLNGDHZ-UHFFFAOYSA-N
Mol Weight 624.8 g/mol
Molecular Formula C38H44N2O4S
Exact Mass 624.302179 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8C4WNS61X82
Name 2-(4-isobutylphenyl)-N-{4-[(4-{[2-(4-isobutylphenyl)propanoyl]amino}phenyl)sulfonyl]phenyl}propanamide
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/C38H44N2O4S/c1-25(2)23-29-7-11-31(12-8-29)27(5)37(41)39-33-15-19-35(20-16-33)45(43,44)36-21-17-34(18-22-36)40-38(42)28(6)32-13-9-30(10-14-32)24-26(3)4/h7-22,25-28H,23-24H2,1-6H3,(H,39,41)(H,40,42)
InChIKey VZCBCUSSLNGDHZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_254
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: 601704GRAN4-012; Labnumber: 601704GRAN4-012; VK_ID: VK-000255
Temperature 308 °C