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2-[(4-oxidoquinoxalin-4-ium-2-carbonyl)amino]propionic acid methyl ester
SpectraBase Compound ID FJGv0ithdV1
InChI InChI=1S/C13H13N3O4/c1-8(13(18)20-2)14-12(17)10-7-16(19)11-6-4-3-5-9(11)15-10/h3-8H,1-2H3,(H,14,17)
InChIKey ZSVUIKWSMASTIB-UHFFFAOYSA-N
Mol Weight 275.26 g/mol
Molecular Formula C13H13N3O4
Exact Mass 275.090606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KuKkGRH7zIC
Name 2-[(4-oxidoquinoxalin-4-ium-2-carbonyl)amino]propionic acid methyl ester
Compound Number 2C
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Formula C13H13N3O4
InChI InChI=1S/C13H13N3O4/c1-8(13(18)20-2)14-12(17)10-7-16(19)11-6-4-3-5-9(11)15-10/h3-8H,1-2H3,(H,14,17)
InChIKey ZSVUIKWSMASTIB-UHFFFAOYSA-N
Literature Reference Author S.S.SABRI,M.M.EL-ABADELAH,H.I.TASHTOUSH,H.DUDDECK
Literature Reference Citation HETEROCYCLES,24,3169(1986)
Literature Reference DOI 10.3987/R-1986-11-3169
Molecular Weight 275.264 g/mol
Solvent CDCl3
Source File Reference UWED8965