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1-(4-methoxyphenyl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl}-2,5-pyrrolidinedione
SpectraBase Compound ID ECDUYyXdsHn
InChI InChI=1S/C22H21F3N4O5/c1-34-16-5-3-15(4-6-16)28-20(30)13-19(21(28)31)27-10-8-26(9-11-27)17-7-2-14(22(23,24)25)12-18(17)29(32)33/h2-7,12,19H,8-11,13H2,1H3
InChIKey HGINQJYNCOMGSY-UHFFFAOYSA-N
Mol Weight 478.43 g/mol
Molecular Formula C22H21F3N4O5
Exact Mass 478.146404 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2t3xUBt1nNZ
Name 1-(4-methoxyphenyl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl}-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/C22H21F3N4O5/c1-34-16-5-3-15(4-6-16)28-20(30)13-19(21(28)31)27-10-8-26(9-11-27)17-7-2-14(22(23,24)25)12-18(17)29(32)33/h2-7,12,19H,8-11,13H2,1H3
InChIKey HGINQJYNCOMGSY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18886
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: D11834; Labnumber: MPOL-15884; SBI_ID: SBI-018889
Temperature 308 °C