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ethanone, 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-(4-methyl-1-piperidinyl)-
SpectraBase Compound ID IjvZFSBrnSu
InChI InChI=1S/C21H24ClF3N2O/c1-13-6-8-26(9-7-13)12-20(28)17-10-14(2)27(15(17)3)16-4-5-19(22)18(11-16)21(23,24)25/h4-5,10-11,13H,6-9,12H2,1-3H3
InChIKey WQQYNMWVLPWGKY-UHFFFAOYSA-N
Mol Weight 412.88 g/mol
Molecular Formula C21H24ClF3N2O
Exact Mass 412.152926 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IrBKUuw2X6U
Name ethanone, 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl]-2-(4-methyl-1-piperidinyl)-
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/C21H24ClF3N2O/c1-13-6-8-26(9-7-13)12-20(28)17-10-14(2)27(15(17)3)16-4-5-19(22)18(11-16)21(23,24)25/h4-5,10-11,13H,6-9,12H2,1-3H3
InChIKey WQQYNMWVLPWGKY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_853
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/11228539