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1-Homoveratryl-3-[4-(4-methoxyphenyl)piperazino]pyrrolidine-2,5-quinone

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1-Homoveratryl-3-[4-(4-methoxyphenyl)piperazino]pyrrolidine-2,5-quinone
SpectraBase Compound ID 1qmTKM0ljEs
InChI InChI=1S/C25H31N3O5/c1-31-20-7-5-19(6-8-20)26-12-14-27(15-13-26)21-17-24(29)28(25(21)30)11-10-18-4-9-22(32-2)23(16-18)33-3/h4-9,16,21H,10-15,17H2,1-3H3
InChIKey BKXPHEILLJNLNP-UHFFFAOYSA-N
Mol Weight 453.54 g/mol
Molecular Formula C25H31N3O5
Exact Mass 453.226371 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7wzpLUZSdcO
Name 2,5-pyrrolidinedione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(4-methoxyphenyl)-1-piperazinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.226371105 u
Formula C25H31N3O5
InChI InChI=1S/C25H31N3O5/c1-31-20-7-5-19(6-8-20)26-12-14-27(15-13-26)21-17-24(29)28(25(21)30)11-10-18-4-9-22(32-2)23(16-18)33-3/h4-9,16,21H,10-15,17H2,1-3H3
InChIKey BKXPHEILLJNLNP-UHFFFAOYSA-N
Molecular Weight 453.539 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8495
Solvent DMSO-d6
Source Vendor ID: NMR/9322850; Lab Info: PE; Lab Number: PE-0129959