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N-benzyl-4-[(1-(2-cyanobenzyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide
SpectraBase Compound ID BT6IuG1CnVX
InChI InChI=1S/C31H30N4O3/c32-18-25-10-4-5-11-26(25)21-34-28-13-7-6-12-27(28)30(37)35(31(34)38)20-23-14-16-24(17-15-23)29(36)33-19-22-8-2-1-3-9-22/h1-13,23-24H,14-17,19-21H2,(H,33,36)
InChIKey JJKQCRYLVDYGDN-UHFFFAOYSA-N
Mol Weight 506.61 g/mol
Molecular Formula C31H30N4O3
Exact Mass 506.231791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5rGK3r7hVNa
Name N-benzyl-4-[(1-(2-cyanobenzyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 506.231790839 u
Formula C31H30N4O3
InChI InChI=1S/C31H30N4O3/c32-18-25-10-4-5-11-26(25)21-34-28-13-7-6-12-27(28)30(37)35(31(34)38)20-23-14-16-24(17-15-23)29(36)33-19-22-8-2-1-3-9-22/h1-13,23-24H,14-17,19-21H2,(H,33,36)
InChIKey JJKQCRYLVDYGDN-UHFFFAOYSA-N
Molecular Weight 506.606 g/mol
NMR Offset 18.0154
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9390
Solvent DMSO-d6
Source Vendor ID: NMR/13229268