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1-(1,3-Benzodioxol-5-yl)-3-[4-(2-furoyl)-1-piperazinyl]-2,5-pyrrolidinedione
SpectraBase Compound ID EB0JZW9NfdM
InChI InChI=1S/C20H19N3O6/c24-18-11-14(19(25)23(18)13-3-4-15-17(10-13)29-12-28-15)21-5-7-22(8-6-21)20(26)16-2-1-9-27-16/h1-4,9-10,14H,5-8,11-12H2
InChIKey VIBTXOKSWZEOQK-UHFFFAOYSA-N
Mol Weight 397.39 g/mol
Molecular Formula C20H19N3O6
Exact Mass 397.127385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XqF8aThiJT
Name 1-(1,3-Benzodioxol-5-yl)-3-[4-(2-furoyl)-1-piperazinyl]-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.127385338 u
Formula C20H19N3O6
InChI InChI=1S/C20H19N3O6/c24-18-11-14(19(25)23(18)13-3-4-15-17(10-13)29-12-28-15)21-5-7-22(8-6-21)20(26)16-2-1-9-27-16/h1-4,9-10,14H,5-8,11-12H2
InChIKey VIBTXOKSWZEOQK-UHFFFAOYSA-N
Molecular Weight 397.387 g/mol
SMILES C=1C=2OCOC2C=C(N2C(C(N3CCN(C(C=4OC=CC4)=O)CC3)CC2=O)=O)C1