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3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(3-chloro-4-methylphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID HJJwid8XWFI
InChI InChI=1S/C23H24ClN3O4/c1-15-2-4-17(11-18(15)24)27-22(28)12-19(23(27)29)26-8-6-25(7-9-26)13-16-3-5-20-21(10-16)31-14-30-20/h2-5,10-11,19H,6-9,12-14H2,1H3
InChIKey FESAVINAIRTZJW-UHFFFAOYSA-N
Mol Weight 441.92 g/mol
Molecular Formula C23H24ClN3O4
Exact Mass 441.145534 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1vIFu13iVma
Name 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(3-chloro-4-methylphenyl)-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/C23H24ClN3O4/c1-15-2-4-17(11-18(15)24)27-22(28)12-19(23(27)29)26-8-6-25(7-9-26)13-16-3-5-20-21(10-16)31-14-30-20/h2-5,10-11,19H,6-9,12-14H2,1H3
InChIKey FESAVINAIRTZJW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12790
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: UZI/9125511; UBI_ID: UBI-012793
Temperature 318 °C