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1H-indole, 1-acetyl-5-bromo-7-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-2,3-dihydro-2-methyl-
SpectraBase Compound ID 3IHLll2kHbw
InChI InChI=1S/C21H23BrFN3O3S/c1-14-11-16-12-17(22)13-20(21(16)26(14)15(2)27)30(28,29)25-9-7-24(8-10-25)19-5-3-18(23)4-6-19/h3-6,12-14H,7-11H2,1-2H3
InChIKey IKVMZVJYFXXNTD-UHFFFAOYSA-N
Mol Weight 496.4 g/mol
Molecular Formula C21H23BrFN3O3S
Exact Mass 495.062754 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C4DHI0dNvid
Name 1H-indole, 1-acetyl-5-bromo-7-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-2,3-dihydro-2-methyl-
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/C21H23BrFN3O3S/c1-14-11-16-12-17(22)13-20(21(16)26(14)15(2)27)30(28,29)25-9-7-24(8-10-25)19-5-3-18(23)4-6-19/h3-6,12-14H,7-11H2,1-2H3
InChIKey IKVMZVJYFXXNTD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_8032
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/12258144