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N-(2-chlorobenzyl)-4-[(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]benzamide
SpectraBase Compound ID ChjCs07ppVp
InChI InChI=1S/C33H33ClN4O4/c34-28-12-6-4-10-26(28)20-36-31(40)25-16-14-24(15-17-25)21-38-32(41)27-11-5-7-13-29(27)37(33(38)42)22-30(39)35-19-18-23-8-2-1-3-9-23/h4-8,10-17H,1-3,9,18-22H2,(H,35,39)(H,36,40)
InChIKey CMPSWIRXNVRNPR-UHFFFAOYSA-N
Mol Weight 585.1 g/mol
Molecular Formula C33H33ClN4O4
Exact Mass 584.219033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DtcYac9CXfZ
Name N-(2-chlorobenzyl)-4-[(1-(2-{[2-(1-cyclohexen-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]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 584.219033255 u
Formula C33H33ClN4O4
InChI InChI=1S/C33H33ClN4O4/c34-28-12-6-4-10-26(28)20-36-31(40)25-16-14-24(15-17-25)21-38-32(41)27-11-5-7-13-29(27)37(33(38)42)22-30(39)35-19-18-23-8-2-1-3-9-23/h4-8,10-17H,1-3,9,18-22H2,(H,35,39)(H,36,40)
InChIKey CMPSWIRXNVRNPR-UHFFFAOYSA-N
Molecular Weight 585.104 g/mol
NMR Offset 17.9999
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9570
Solvent DMSO-d6
Source Vendor ID: NMR/13229481