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cyclohexanecarboxamide, 4-[[[(4-fluorophenyl)sulfonyl]amino]methyl]-N-[2-oxo-2-[(2-pyridinylmethyl)amino]ethyl]-
SpectraBase Compound ID KXYNnODUmEF
InChI InChI=1S/C22H27FN4O4S/c23-18-8-10-20(11-9-18)32(30,31)27-13-16-4-6-17(7-5-16)22(29)26-15-21(28)25-14-19-3-1-2-12-24-19/h1-3,8-12,16-17,27H,4-7,13-15H2,(H,25,28)(H,26,29)
InChIKey RORCOPKIEBCORA-UHFFFAOYSA-N
Mol Weight 462.54 g/mol
Molecular Formula C22H27FN4O4S
Exact Mass 462.173705 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BmX9pWA2YYK
Name cyclohexanecarboxamide, 4-[[[(4-fluorophenyl)sulfonyl]amino]methyl]-N-[2-oxo-2-[(2-pyridinylmethyl)amino]ethyl]-
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/C22H27FN4O4S/c23-18-8-10-20(11-9-18)32(30,31)27-13-16-4-6-17(7-5-16)22(29)26-15-21(28)25-14-19-3-1-2-12-24-19/h1-3,8-12,16-17,27H,4-7,13-15H2,(H,25,28)(H,26,29)
InChIKey RORCOPKIEBCORA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7167
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: F30006; Labnumber: ExLab-N0249-1637