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methyl 4-({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}sulfonyl)phenyl ether
SpectraBase Compound ID 6QDk1aFExDw
InChI InChI=1S/C18H19F3N2O3S/c1-26-16-5-7-17(8-6-16)27(24,25)23-11-9-22(10-12-23)15-4-2-3-14(13-15)18(19,20)21/h2-8,13H,9-12H2,1H3
InChIKey VEDBISVSESZKMF-UHFFFAOYSA-N
Mol Weight 400.42 g/mol
Molecular Formula C18H19F3N2O3S
Exact Mass 400.106848 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1QsBXqJWhq0
Name methyl 4-({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}sulfonyl)phenyl ether
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/C18H19F3N2O3S/c1-26-16-5-7-17(8-6-16)27(24,25)23-11-9-22(10-12-23)15-4-2-3-14(13-15)18(19,20)21/h2-8,13H,9-12H2,1H3
InChIKey VEDBISVSESZKMF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34781
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: 9344411; SBI_ID: SBI-034785
Synonyms 1-[(4-methoxyphenyl)sulfonyl]-4-[3-(trifluoromethyl)phenyl]piperazine
Temperature 318 °C