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(1-{2-[4-bromo-2-(2-chlorobenzoyl)anilino]-2-oxoethyl}cyclopentyl)acetic acid
SpectraBase Compound ID CZKWNNwe9dD
InChI InChI=1S/C22H21BrClNO4/c23-14-7-8-18(16(11-14)21(29)15-5-1-2-6-17(15)24)25-19(26)12-22(13-20(27)28)9-3-4-10-22/h1-2,5-8,11H,3-4,9-10,12-13H2,(H,25,26)(H,27,28)
InChIKey MLZKVTOIELNYIR-UHFFFAOYSA-N
Mol Weight 478.77 g/mol
Molecular Formula C22H21BrClNO4
Exact Mass 477.034249 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 38znZywUZvk
Name (1-{2-[4-bromo-2-(2-chlorobenzoyl)anilino]-2-oxoethyl}cyclopentyl)acetic 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/C22H21BrClNO4/c23-14-7-8-18(16(11-14)21(29)15-5-1-2-6-17(15)24)25-19(26)12-22(13-20(27)28)9-3-4-10-22/h1-2,5-8,11H,3-4,9-10,12-13H2,(H,25,26)(H,27,28)
InChIKey MLZKVTOIELNYIR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3426
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: D11488; Labnumber: ExPavl-0164; SBI_ID: SBI-003428
Temperature 318 °C