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4(3H)-quinazolinone, 6-bromo-2-[[(4,6-diamino-2-pyrimidinyl)thio]methyl]-
SpectraBase Compound ID HyEOEbkHEYm
InChI InChI=1S/C13H11BrN6OS/c14-6-1-2-8-7(3-6)12(21)20-11(17-8)5-22-13-18-9(15)4-10(16)19-13/h1-4H,5H2,(H,17,20,21)(H4,15,16,18,19)
InChIKey VRARHYRJAKYFBA-UHFFFAOYSA-N
Mol Weight 379.24 g/mol
Molecular Formula C13H11BrN6OS
Exact Mass 377.989843 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7aybFAYdadO
Name 4(3H)-quinazolinone, 6-bromo-2-[[(4,6-diamino-2-pyrimidinyl)thio]methyl]-
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/C13H11BrN6OS/c14-6-1-2-8-7(3-6)12(21)20-11(17-8)5-22-13-18-9(15)4-10(16)19-13/h1-4H,5H2,(H,17,20,21)(H4,15,16,18,19)
InChIKey VRARHYRJAKYFBA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3994
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/17241133; Labnumber: KUL-0000001