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4-[(E)-({[[(4-bromophenyl)sulfonyl](cyclohexyl)amino]acetyl}hydrazono)methyl]benzoic acid
SpectraBase Compound ID LEBr5GQTQnK
InChI InChI=1S/C22H24BrN3O5S/c23-18-10-12-20(13-11-18)32(30,31)26(19-4-2-1-3-5-19)15-21(27)25-24-14-16-6-8-17(9-7-16)22(28)29/h6-14,19H,1-5,15H2,(H,25,27)(H,28,29)/b24-14+
InChIKey FYIQKIGHDYSMJH-ZVHZXABRSA-N
Mol Weight 522.41 g/mol
Molecular Formula C22H24BrN3O5S
Exact Mass 521.062005 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9NMXc130yCj
Name 4-[(E)-({[[(4-bromophenyl)sulfonyl](cyclohexyl)amino]acetyl}hydrazono)methyl]benzoic acid
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/C22H24BrN3O5S/c23-18-10-12-20(13-11-18)32(30,31)26(19-4-2-1-3-5-19)15-21(27)25-24-14-16-6-8-17(9-7-16)22(28)29/h6-14,19H,1-5,15H2,(H,25,27)(H,28,29)/b24-14+
InChIKey FYIQKIGHDYSMJH-ZVHZXABRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_161
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: /VSVE61216; UBI_ID: UBI-000162
Synonyms 4-[({[[(4-bromophenyl)sulfonyl](cyclohexyl)amino]acetyl}hydrazono)methyl]benzoic acid
Temperature 318 °C