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4-[(1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]-N-(4-methylbenzyl)benzamide

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4-[(1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]-N-(4-methylbenzyl)benzamide
SpectraBase Compound ID 8Zp7Chsr82a
InChI InChI=1S/C33H36N4O4/c1-23-12-14-24(15-13-23)20-34-31(39)26-18-16-25(17-19-26)21-37-32(40)28-10-6-7-11-29(28)36(33(37)41)22-30(38)35(2)27-8-4-3-5-9-27/h6-7,10-19,27H,3-5,8-9,20-22H2,1-2H3,(H,34,39)
InChIKey TWIYHDGTCWSFOR-UHFFFAOYSA-N
Mol Weight 552.7 g/mol
Molecular Formula C33H36N4O4
Exact Mass 552.273656 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LH2F5s2uQOQ
Name 4-[(1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]-N-(4-methylbenzyl)benzamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 552.273655651 u
Formula C33H36N4O4
InChI InChI=1S/C33H36N4O4/c1-23-12-14-24(15-13-23)20-34-31(39)26-18-16-25(17-19-26)21-37-32(40)28-10-6-7-11-29(28)36(33(37)41)22-30(38)35(2)27-8-4-3-5-9-27/h6-7,10-19,27H,3-5,8-9,20-22H2,1-2H3,(H,34,39)
InChIKey TWIYHDGTCWSFOR-UHFFFAOYSA-N
Molecular Weight 552.675 g/mol
NMR Offset 17.9995
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9558
Solvent DMSO-d6
Source Vendor ID: NMR/13229463