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3-[4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)-1-piperazinyl]-1-(4-fluorophenyl)-2,5-pyrrolidinedione

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3-[4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)-1-piperazinyl]-1-(4-fluorophenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID F2wwRttwtng
InChI InChI=1S/C25H31FN4O4/c1-25(2)14-21(31)19(22(32)15-25)16-27-7-8-28-9-11-29(12-10-28)20-13-23(33)30(24(20)34)18-5-3-17(26)4-6-18/h3-6,16,20,27H,7-15H2,1-2H3
InChIKey KHWTTYMJGZJOKG-UHFFFAOYSA-N
Mol Weight 470.55 g/mol
Molecular Formula C25H31FN4O4
Exact Mass 470.232934 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CEMkGlCLur1
Name 3-[4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)-1-piperazinyl]-1-(4-fluorophenyl)-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/C25H31FN4O4/c1-25(2)14-21(31)19(22(32)15-25)16-27-7-8-28-9-11-29(12-10-28)20-13-23(33)30(24(20)34)18-5-3-17(26)4-6-18/h3-6,16,20,27H,7-15H2,1-2H3
InChIKey KHWTTYMJGZJOKG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10110
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: 134560; Labnumber: VLMP-1883; VK_ID: VK-010114
Temperature 308 °C