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SFTRGQYOANYSFS-UHFFFAOYSA-N
SpectraBase Compound ID HxIkTX6HNTa
InChI InChI=1S/C7H11N5O5S2/c1-12-6(8)18-7(10-12)19(16,17)11-4(13)2-9-3-5(14)15/h8-9H,2-3H2,1H3,(H,11,13)(H,14,15)
InChIKey SFTRGQYOANYSFS-UHFFFAOYSA-N
Mol Weight 309.32 g/mol
Molecular Formula C7H11N5O5S2
Exact Mass 309.020161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lsu0sdOYIPl
Name SFTRGQYOANYSFS-UHFFFAOYSA-N
Compound Number 1N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H11N5O5S2
InChI InChI=1S/C7H11N5O5S2/c1-12-6(8)18-7(10-12)19(16,17)11-4(13)2-9-3-5(14)15/h8-9H,2-3H2,1H3,(H,11,13)(H,14,15)
InChIKey SFTRGQYOANYSFS-UHFFFAOYSA-N
Literature Reference Author A.SCOZZAFAVA,L.MENABUONI,F.MINCIONE,C.T.SUPURAN
Literature Reference Citation J.MED.CHEM.,45,1466(2002)
Literature Reference DOI 10.1021/jm0108202
Molecular Weight 309.315 g/mol
Sample ID 40933
Solvent SOLID-STATE