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(E)-6-BROMO-4'-DEMETHYL-3'-N-METHYL-APLYSINOPSIN
SpectraBase Compound ID 4bJXYHgSAfO
InChI InChI=1S/C14H13BrN4O/c1-16-14-18-13(20)12(19(14)2)5-8-7-17-11-6-9(15)3-4-10(8)11/h3-7,17H,1-2H3,(H,16,18,20)/b12-5+
InChIKey LKVQIMAPGZMTJI-LFYBBSHMSA-N
Mol Weight 333.19 g/mol
Molecular Formula C14H13BrN4O
Exact Mass 332.027274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SCHn5mnbQw
Name (E)-1,5-DIHYDRO-5-[(6-BROMO-1H-INDOL-3-YL)-METHYLIDENE]-1-METHYL-2-(METHYLAMINO)-4H-IMIDAZOL-4-ONE;(E)-4'-DEMETHYL-3'-N-METHYLPLYSINOPSIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13BrN4O
InChI InChI=1S/C14H13BrN4O/c1-16-14-18-13(20)12(19(14)2)5-8-7-17-11-6-9(15)3-4-10(8)11/h3-7,17H,1-2H3,(H,16,18,20)/b12-5+
InChIKey LKVQIMAPGZMTJI-LFYBBSHMSA-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 333.187 g/mol
Solvent DMSO-D6
Source File Reference UWED15683