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(E)-2-ETHYL-1-METHYL-7-OXIMINO-DIPYRROLO-PYRIMIDINE-3,5-DIONE;MAJOR-ISOMER
SpectraBase Compound ID Epw7hSnkI5a
InChI InChI=1S/C14H13N3O3/c1-3-11-8(2)12-6-9-4-5-10(7-15-20)16(9)14(19)17(12)13(11)18/h4-7,20H,3H2,1-2H3/b15-7+
InChIKey JTJOEYNVQBIXFN-VIZOYTHASA-N
Mol Weight 271.28 g/mol
Molecular Formula C14H13N3O3
Exact Mass 271.095691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4WcKttD6Spt
Name (E)-2-ETHYL-1-METHYL-7-OXIMINO-DIPYRROLO-PYRIMIDINE-3,5-DIONE;MAJOR-ISOMER
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12N3O3
InChI InChI=1S/C14H13N3O3/c1-3-11-8(2)12-6-9-4-5-10(7-15-20)16(9)14(19)17(12)13(11)18/h4-7,20H,3H2,1-2H3/b15-7+
InChIKey JTJOEYNVQBIXFN-VIZOYTHASA-N
Literature Reference Author I.WALTON,M.DAVIS,L.YANG,Y.ZHANG,D.TILLMAN,W.L.JARRETT,M.T.HU GGINS,K.J.WALLACE
Literature Reference Citation MAGN.RES.CHEM.,49,205(2011)
Literature Reference DOI 10.1002/mrc.2728
Molecular Weight 270.268 g/mol
Solvent DMSO-D6
Source File Reference UWBT12863