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3-ETHOXYCARBONYL-1,2,4-TRIAZOLO-[5.1-C]-1,2,4-TRIAZIN-4-ONE
SpectraBase Compound ID 6vCpN5GoXXA
InChI InChI=1S/C7H7N5O3/c1-2-15-6(14)4-5(13)12-7(11-10-4)8-3-9-12/h3H,2H2,1H3,(H,8,9,11)
InChIKey HPTXCTZWNNOLTR-UHFFFAOYSA-N
Mol Weight 209.16 g/mol
Molecular Formula C7H7N5O3
Exact Mass 209.054889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVHmT5RmtPZ
Name 3-ETHOXYCARBONYL-1,2,4-TRIAZOLO-[5.1-C]-1,2,4-TRIAZIN-4-ONE
Compound Number ID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7N5O3
InChI InChI=1S/C7H7N5O3/c1-2-15-6(14)4-5(13)12-7(11-10-4)8-3-9-12/h3H,2H2,1H3,(H,8,9,11)
InChIKey HPTXCTZWNNOLTR-UHFFFAOYSA-N
Literature Reference Author E.N.ULOMSKII,S.L.DEEV,A.V.TKACHEV,I.K.MOISEEV,V.L.RUSINOV
Literature Reference Citation RUSS.J.ORG.CHEM.,38,272(2002)
Literature Reference DOI 10.1023/A:1015538322029
Molecular Weight 209.164 g/mol
Solvent DMSO-D6