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3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(3,4-dichlorophenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID 5GBnlRPjP3a
InChI InChI=1S/C22H21Cl2N3O4/c23-16-3-2-15(10-17(16)24)27-21(28)11-18(22(27)29)26-7-5-25(6-8-26)12-14-1-4-19-20(9-14)31-13-30-19/h1-4,9-10,18H,5-8,11-13H2
InChIKey GHMLUJWWEFSBBI-UHFFFAOYSA-N
Mol Weight 462.33 g/mol
Molecular Formula C22H21Cl2N3O4
Exact Mass 461.090912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GbgfX5Vzr5J
Name 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(3,4-dichlorophenyl)-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/C22H21Cl2N3O4/c23-16-3-2-15(10-17(16)24)27-21(28)11-18(22(27)29)26-7-5-25(6-8-26)12-14-1-4-19-20(9-14)31-13-30-19/h1-4,9-10,18H,5-8,11-13H2
InChIKey GHMLUJWWEFSBBI-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7889
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: 127844; Labnumber: VLMP-0735; VK_ID: VK-007893
Temperature 308 °C