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(3E)-3-[(3,5-dimethylphenyl)imino]-1-{[4-(2-fluorophenyl)-1-piperazinyl]methyl}-1,3-dihydro-2H-indol-2-one
SpectraBase Compound ID IWO0mgNdl3y
InChI InChI=1S/C27H27FN4O/c1-19-15-20(2)17-21(16-19)29-26-22-7-3-5-9-24(22)32(27(26)33)18-30-11-13-31(14-12-30)25-10-6-4-8-23(25)28/h3-10,15-17H,11-14,18H2,1-2H3/b29-26+
InChIKey WTQFWBTUUIUMTB-PBBVDAKRSA-N
Mol Weight 442.54 g/mol
Molecular Formula C27H27FN4O
Exact Mass 442.21689 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5gz9mdVDlNk
Name (3E)-3-[(3,5-dimethylphenyl)imino]-1-{[4-(2-fluorophenyl)-1-piperazinyl]methyl}-1,3-dihydro-2H-indol-2-one
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/C27H27FN4O/c1-19-15-20(2)17-21(16-19)29-26-22-7-3-5-9-24(22)32(27(26)33)18-30-11-13-31(14-12-30)25-10-6-4-8-23(25)28/h3-10,15-17H,11-14,18H2,1-2H3/b29-26+
InChIKey WTQFWBTUUIUMTB-PBBVDAKRSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5877
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/11241331; Labnumber: LP-0103482; IOH_ID: IOH-005878
Synonyms 3-[(3,5-dimethylphenyl)imino]-1-{[4-(2-fluorophenyl)-1-piperazinyl]methyl}-1,3-dihydro-2H-indol-2-one