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1-[(3-bromo-4-methoxyphenyl)sulfonyl]-4-(4-fluorophenyl)piperazine
SpectraBase Compound ID 8cioKikIzJY
InChI InChI=1S/C17H18BrFN2O3S/c1-24-17-7-6-15(12-16(17)18)25(22,23)21-10-8-20(9-11-21)14-4-2-13(19)3-5-14/h2-7,12H,8-11H2,1H3
InChIKey SCMJZGZZVXWNAP-UHFFFAOYSA-N
Mol Weight 429.3 g/mol
Molecular Formula C17H18BrFN2O3S
Exact Mass 428.020555 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Is8bhvurIvm
Name 1-[(3-bromo-4-methoxyphenyl)sulfonyl]-4-(4-fluorophenyl)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/C17H18BrFN2O3S/c1-24-17-7-6-15(12-16(17)18)25(22,23)21-10-8-20(9-11-21)14-4-2-13(19)3-5-14/h2-7,12H,8-11H2,1H3
InChIKey SCMJZGZZVXWNAP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7194
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: D48055; Labnumber: SPDEM5-36085; SBI_ID: SBI-007197
Synonyms 2-bromo-4-{[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl}phenyl methyl ether
Temperature 318 °C