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1-(4-Ethoxyphenyl)-3-[4-(2-methoxyphenyl)-1-piperazinyl]-2,5-pyrrolidinedione
SpectraBase Compound ID EOoDfY03Dk5
InChI InChI=1S/C23H27N3O4/c1-3-30-18-10-8-17(9-11-18)26-22(27)16-20(23(26)28)25-14-12-24(13-15-25)19-6-4-5-7-21(19)29-2/h4-11,20H,3,12-16H2,1-2H3
InChIKey IVTQBWBBHGTGCZ-UHFFFAOYSA-N
Mol Weight 409.49 g/mol
Molecular Formula C23H27N3O4
Exact Mass 409.200156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5D4bDQVt00o
Name 1-(4-Ethoxyphenyl)-3-[4-(2-methoxyphenyl)-1-piperazinyl]-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.200156357 u
Formula C23H27N3O4
InChI InChI=1S/C23H27N3O4/c1-3-30-18-10-8-17(9-11-18)26-22(27)16-20(23(26)28)25-14-12-24(13-15-25)19-6-4-5-7-21(19)29-2/h4-11,20H,3,12-16H2,1-2H3
InChIKey IVTQBWBBHGTGCZ-UHFFFAOYSA-N
Molecular Weight 409.486 g/mol
SMILES C=1C=CC(N2CCN(C3C(N(C(C3)=O)C3=CC=C(C=C3)OCC)=O)CC2)=C(OC)C1