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AKOYYWJWILIASW-WCIBSUBMSA-N

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AKOYYWJWILIASW-WCIBSUBMSA-N
SpectraBase Compound ID I0TWMLVKJqK
InChI InChI=1S/C13H11BrN4O/c1-18-12(19)11(17-13(18)15)4-7-6-16-10-5-8(14)2-3-9(7)10/h2-6,16H,1H3,(H2,15,17)/b11-4-
InChIKey AKOYYWJWILIASW-WCIBSUBMSA-N
Mol Weight 319.16 g/mol
Molecular Formula C13H11BrN4O
Exact Mass 318.011624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BOLOHSuz1Xa
Name AKOYYWJWILIASW-WCIBSUBMSA-N
Compound Number (E)-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11BrN4O
InChI InChI=1S/C13H11BrN4O/c1-18-12(19)11(17-13(18)15)4-7-6-16-10-5-8(14)2-3-9(7)10/h2-6,16H,1H3,(H2,15,17)/b11-4-
InChIKey AKOYYWJWILIASW-WCIBSUBMSA-N
Literature Reference Author G.GUELLA,I.MANCINI,H.ZIBROWIUS,F.PIETRA
Literature Reference Citation HELV.CHIM.ACTA,72,1444(1989)
Literature Reference DOI 10.1002/hlca.19890720703
Molecular Weight 319.161 g/mol
Solvent DMSO-D6
Source File Reference UWED15680