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2-{2-methoxy-5-[3-(4-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-2-quinazolinyl]benzyl}-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 9MlNpHTVnER
InChI InChI=1S/C31H25N3O4/c1-19-11-14-22(15-12-19)34-28(32-26-10-6-5-9-25(26)31(34)37)20-13-16-27(38-2)21(17-20)18-33-29(35)23-7-3-4-8-24(23)30(33)36/h3-17,28,32H,18H2,1-2H3
InChIKey OWZVSKWKCXNZJI-UHFFFAOYSA-N
Mol Weight 503.56 g/mol
Molecular Formula C31H25N3O4
Exact Mass 503.184506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3qhYzJ4VB3h
Name 2-{2-methoxy-5-[3-(4-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-2-quinazolinyl]benzyl}-1H-isoindole-1,3(2H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C31H25N3O4/c1-19-11-14-22(15-12-19)34-28(32-26-10-6-5-9-25(26)31(34)37)20-13-16-27(38-2)21(17-20)18-33-29(35)23-7-3-4-8-24(23)30(33)36/h3-17,28,32H,18H2,1-2H3
InChIKey OWZVSKWKCXNZJI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12623
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 101094; Labnumber: NCD1-095; VK_ID: VK-012628
Temperature 318 °C