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1H-purine-2,6-dione, 7-[(6-bromo-4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-3,7-dihydro-1,3-dimethyl-
SpectraBase Compound ID CFn1uXhDqvB
InChI InChI=1S/C15H12BrN7O3/c1-20-12-11(14(25)21(2)15(20)26)22(6-17-12)7-23-13(24)9-5-8(16)3-4-10(9)18-19-23/h3-6H,7H2,1-2H3
InChIKey ROPHLPYDOHDROX-UHFFFAOYSA-N
Mol Weight 418.21 g/mol
Molecular Formula C15H12BrN7O3
Exact Mass 417.0185 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ErNBBXmdANm
Name 1H-purine-2,6-dione, 7-[(6-bromo-4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-3,7-dihydro-1,3-dimethyl-
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/C15H12BrN7O3/c1-20-12-11(14(25)21(2)15(20)26)22(6-17-12)7-23-13(24)9-5-8(16)3-4-10(9)18-19-23/h3-6H,7H2,1-2H3
InChIKey ROPHLPYDOHDROX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3995
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/17241137; Labnumber: KUL-0000005