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3-[2-(3,4-dimethoxyphenyl)ethyl]-7-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}-2,4(1H,3H)-quinazolinedione
SpectraBase Compound ID JlGXNiP0nB
InChI InChI=1S/C28H29N5O5/c1-37-23-9-6-19(17-24(23)38-2)10-12-33-27(35)21-8-7-20(18-22(21)30-28(33)36)26(34)32-15-13-31(14-16-32)25-5-3-4-11-29-25/h3-9,11,17-18H,10,12-16H2,1-2H3,(H,30,36)
InChIKey VLBDYKQXPJZPNL-UHFFFAOYSA-N
Mol Weight 515.57 g/mol
Molecular Formula C28H29N5O5
Exact Mass 515.216869 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ILYPxJhoLH
Name 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}-2,4(1H,3H)-quinazolinedione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 515.216869049 u
Formula C28H29N5O5
InChI InChI=1S/C28H29N5O5/c1-37-23-9-6-19(17-24(23)38-2)10-12-33-27(35)21-8-7-20(18-22(21)30-28(33)36)26(34)32-15-13-31(14-16-32)25-5-3-4-11-29-25/h3-9,11,17-18H,10,12-16H2,1-2H3,(H,30,36)
InChIKey VLBDYKQXPJZPNL-UHFFFAOYSA-N
Molecular Weight 515.570 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8467
Solvent DMSO-d6
Source Vendor ID: NMR/13219665