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1-piperazinecarboxylic acid, 4-[[[4-chloro-3-(trifluoromethyl)phenyl][(4-methylphenyl)sulfonyl]amino]acetyl]-, ethyl ester

View entire compound with spectra: 1 NMR

1-piperazinecarboxylic acid, 4-[[[4-chloro-3-(trifluoromethyl)phenyl][(4-methylphenyl)sulfonyl]amino]acetyl]-, ethyl ester
SpectraBase Compound ID 2iwDcgnbk2j
InChI InChI=1S/C23H25ClF3N3O5S/c1-3-35-22(32)29-12-10-28(11-13-29)21(31)15-30(36(33,34)18-7-4-16(2)5-8-18)17-6-9-20(24)19(14-17)23(25,26)27/h4-9,14H,3,10-13,15H2,1-2H3
InChIKey ILUNDCCYHPNSBE-UHFFFAOYSA-N
Mol Weight 547.98 g/mol
Molecular Formula C23H25ClF3N3O5S
Exact Mass 547.115554 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID M17otQgYbu
Name 1-piperazinecarboxylic acid, 4-[[[4-chloro-3-(trifluoromethyl)phenyl][(4-methylphenyl)sulfonyl]amino]acetyl]-, ethyl ester
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/C23H25ClF3N3O5S/c1-3-35-22(32)29-12-10-28(11-13-29)21(31)15-30(36(33,34)18-7-4-16(2)5-8-18)17-6-9-20(24)19(14-17)23(25,26)27/h4-9,14H,3,10-13,15H2,1-2H3
InChIKey ILUNDCCYHPNSBE-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1457
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: NMR/11259657