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1-(2-MERCAPTO-1,3,4-OXADIAZOL-5-YLMETHYL)-4,6-DIMETHYL-1H-[1,2,3]-TRIAZOLO-[4,5-D]-PYRIMIDINE-5,7(4H,6H)-DIONE
SpectraBase Compound ID 8VjUXX3jWWS
InChI InChI=1S/C9H9N7O3S/c1-14-6-5(7(17)15(2)9(14)18)16(13-11-6)3-4-10-12-8(20)19-4/h3H2,1-2H3,(H,12,20)
InChIKey VLGLGECLASYQQK-UHFFFAOYSA-N
Mol Weight 295.28 g/mol
Molecular Formula C9H9N7O3S
Exact Mass 295.048758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KUF5pwtplu7
Name 1-(2-MERCAPTO-1,3,4-OXADIAZOL-5-YLMETHYL)-4,6-DIMETHYL-1H-[1,2,3]-TRIAZOLO-[4,5-D]-PYRIMIDINE-5,7(4H,6H)-DIONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N7O3S
InChI InChI=1S/C9H9N7O3S/c1-14-6-5(7(17)15(2)9(14)18)16(13-11-6)3-4-10-12-8(20)19-4/h3H2,1-2H3,(H,12,20)
InChIKey VLGLGECLASYQQK-UHFFFAOYSA-N
Literature Reference Author F.A.EL-ESSAWY,A.F.KHATTAB,A.A.H.ABDEL-RAHMAN
Literature Reference Citation MH.CHEM.,138,777(2007)
Literature Reference DOI 10.1007/s00706-007-0649-7
Molecular Weight 295.276 g/mol
Sample ID 68577
Solvent DMSO-D6