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GBPHDTKRMDWXGB-AATRIKPKSA-N
SpectraBase Compound ID 4nZKA54mvCg
InChI InChI=1S/C7H8N4O2/c1-6(11(12)13)5-10-7-8-3-2-4-9-7/h2-5H,1H3,(H,8,9,10)/b6-5+
InChIKey GBPHDTKRMDWXGB-AATRIKPKSA-N
Mol Weight 180.17 g/mol
Molecular Formula C7H8N4O2
Exact Mass 180.064726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vwgenYe4MC
Name GBPHDTKRMDWXGB-AATRIKPKSA-N
Compound Number (E)-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H8N4O2
InChI InChI=1S/C7H8N4O2/c1-6(11(12)13)5-10-7-8-3-2-4-9-7/h2-5H,1H3,(H,8,9,10)/b6-5+
InChIKey GBPHDTKRMDWXGB-AATRIKPKSA-N
Literature Reference Author P.E.HANSEN,S.BOLVIG,F.DUUS,M.V.PETROVA,R.KAWECKI,R.KRAJEWSKI ,L.KOZERSKI
Literature Reference Citation MAGN.RES.CHEM.,33,621(1995)
Literature Reference DOI 10.1002/mrc.1260330803
Molecular Weight 180.166 g/mol
Solvent DIOXANE-D8
Source File Reference UWMZ6104