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2-BROMO-7-HYDROXY-6-(3-NITROPHENYLAMINO)-6,7-DIHYDRO-5H-IMIDAZO-[1,2-B]-[1,2,4]-TRIAZIN-3-ONE
SpectraBase Compound ID 3kWn1G9RIap
InChI InChI=1S/C11H9BrN6O4/c12-7-9(19)15-11-14-8(10(20)17(11)16-7)13-5-2-1-3-6(4-5)18(21)22/h1-4,8,10,13,20H,(H,14,15,19)/t8-,10+/m0/s1
InChIKey MUPZJKUHQQNOPX-WCBMZHEXSA-N
Mol Weight 369.14 g/mol
Molecular Formula C11H9BrN6O4
Exact Mass 367.986866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EGO6v2dx01H
Name 2-BROMO-7-HYDROXY-6-(3-NITROPHENYLAMINO)-6,7-DIHYDRO-5H-IMIDAZO-[1,2-B]-[1,2,4]-TRIAZIN-3-ONE
Compound Number 2M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9BrN6O4
InChI InChI=1S/C11H9BrN6O4/c12-7-9(19)15-11-14-8(10(20)17(11)16-7)13-5-2-1-3-6(4-5)18(21)22/h1-4,8,10,13,20H,(H,14,15,19)/t8-,10+/m0/s1
InChIKey MUPZJKUHQQNOPX-WCBMZHEXSA-N
Literature Reference Author E.GARNIER,J.GUILLARD,E.PASQUINET,F.SUZENET,D.POULLAIN,C.JARR Y,J.M.LEGER,B.LEBRET
Literature Reference Citation ORG.LETTERS,5,4595(2003)
Literature Reference DOI 10.1021/ol035743e
Molecular Weight 369.134 g/mol
Sample ID 29331
Solvent DMSO