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3-{4-[bis(4-fluorophenyl)methyl]-1-piperazinyl}-1-(4-propoxyphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID HArqtHYBUQ3
InChI InChI=1S/C30H31F2N3O3/c1-2-19-38-26-13-11-25(12-14-26)35-28(36)20-27(30(35)37)33-15-17-34(18-16-33)29(21-3-7-23(31)8-4-21)22-5-9-24(32)10-6-22/h3-14,27,29H,2,15-20H2,1H3
InChIKey LTULUFULYHQBDV-UHFFFAOYSA-N
Mol Weight 519.59 g/mol
Molecular Formula C30H31F2N3O3
Exact Mass 519.233348 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4z4RXkCwtDV
Name 3-{4-[bis(4-fluorophenyl)methyl]-1-piperazinyl}-1-(4-propoxyphenyl)-2,5-pyrrolidinedione
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/C30H31F2N3O3/c1-2-19-38-26-13-11-25(12-14-26)35-28(36)20-27(30(35)37)33-15-17-34(18-16-33)29(21-3-7-23(31)8-4-21)22-5-9-24(32)10-6-22/h3-14,27,29H,2,15-20H2,1H3
InChIKey LTULUFULYHQBDV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10048
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: 134491; Labnumber: VLMP-0879; VK_ID: VK-010052
Temperature 308 °C