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1-(phenylsulfonyl)-4-{3-[(2,2,2-trifluoroethoxy)methyl]benzoyl}piperazine
SpectraBase Compound ID 8itoYcmNtXV
InChI InChI=1S/C20H21F3N2O4S/c21-20(22,23)15-29-14-16-5-4-6-17(13-16)19(26)24-9-11-25(12-10-24)30(27,28)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2
InChIKey FBOHHJWRIBEHES-UHFFFAOYSA-N
Mol Weight 442.45 g/mol
Molecular Formula C20H21F3N2O4S
Exact Mass 442.117413 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9xfOecj7ad
Name 1-(phenylsulfonyl)-4-{3-[(2,2,2-trifluoroethoxy)methyl]benzoyl}piperazine
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/C20H21F3N2O4S/c21-20(22,23)15-29-14-16-5-4-6-17(13-16)19(26)24-9-11-25(12-10-24)30(27,28)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2
InChIKey FBOHHJWRIBEHES-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30105
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: 1667661; SBI_ID: SBI-030109
Synonyms 3-{[4-(phenylsulfonyl)-1-piperazinyl]carbonyl}benzyl 2,2,2-trifluoroethyl ether
Temperature 306 °C