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5,5'-((4-bromophenyl)methylene)bis(2-imino-1,3-diphenyldihydropyrimidine-4,6(1H,5H)-dione)
SpectraBase Compound ID KfIRl2wQTRs
InChI InChI=1S/C39H29BrN6O4/c40-26-23-21-25(22-24-26)31(32-34(47)43(27-13-5-1-6-14-27)38(41)44(35(32)48)28-15-7-2-8-16-28)33-36(49)45(29-17-9-3-10-18-29)39(42)46(37(33)50)30-19-11-4-12-20-30/h1-24,31-33,41-42H
InChIKey CBCCFLHFUOEUNG-UHFFFAOYSA-N
Mol Weight 725.6 g/mol
Molecular Formula C39H29BrN6O4
Exact Mass 724.143366 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8pSIZk4ONMh
Name 5,5'-((4-bromophenyl)methylene)bis(2-imino-1,3-diphenyldihydropyrimidine-4,6(1H,5H)-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/C39H29BrN6O4/c40-26-23-21-25(22-24-26)31(32-34(47)43(27-13-5-1-6-14-27)38(41)44(35(32)48)28-15-7-2-8-16-28)33-36(49)45(29-17-9-3-10-18-29)39(42)46(37(33)50)30-19-11-4-12-20-30/h1-24,31-33,41-42H
InChIKey CBCCFLHFUOEUNG-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_2865
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: NMR/10218553