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benzoic acid, 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]-
SpectraBase Compound ID 4c8CWrhKPvL
InChI InChI=1S/C23H23N3O6/c27-21-12-18(22(28)26(21)17-4-2-16(3-5-17)23(29)30)25-9-7-24(8-10-25)13-15-1-6-19-20(11-15)32-14-31-19/h1-6,11,18H,7-10,12-14H2,(H,29,30)
InChIKey ZDKJHAGENDGFJN-UHFFFAOYSA-N
Mol Weight 437.45 g/mol
Molecular Formula C23H23N3O6
Exact Mass 437.158685 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Daa6kqPixmP
Name benzoic acid, 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]-
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/C23H23N3O6/c27-21-12-18(22(28)26(21)17-4-2-16(3-5-17)23(29)30)25-9-7-24(8-10-25)13-15-1-6-19-20(11-15)32-14-31-19/h1-6,11,18H,7-10,12-14H2,(H,29,30)
InChIKey ZDKJHAGENDGFJN-UHFFFAOYSA-N
NMR Offset 15.2038
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_3935
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: ZI/6067042; Labnumber: PE-000562; IOH_ID: IOH-010938
Temperature 313 °C