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8-AZA-7,9-DEAZA-7-THIAGUANOSINE
SpectraBase Compound ID 3G7h4vB8T9b
InChI InChI=1S/C10H12N4O5S/c11-10-12-4-3(14-20-8(4)9(18)13-10)7-6(17)5(16)2(1-15)19-7/h2,5-7,15-17H,1H2,(H3,11,12,13,18)/t2-,5-,6-,7-/m0/s1
InChIKey VDXJJPQHRALSLS-ZBAWILKJSA-N
Mol Weight 300.29 g/mol
Molecular Formula C10H12N4O5S
Exact Mass 300.052841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ItRoqMxOewR
Name 8-AZA-7,9-DEAZA-7-THIAGUANOSINE
Compound Number 3-ALPHA
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12N4O5S
InChI InChI=1S/C10H12N4O5S/c11-10-12-4-3(14-20-8(4)9(18)13-10)7-6(17)5(16)2(1-15)19-7/h2,5-7,15-17H,1H2,(H3,11,12,13,18)/t2-,5-,6-,7-/m0/s1
InChIKey VDXJJPQHRALSLS-ZBAWILKJSA-N
Literature Reference Author H.WAMHOFF,R.BERRESSEM,M.NIEGER
Literature Reference Citation J.ORG.CHEM.,59,1912(1994)
Literature Reference DOI 10.1021/jo00086a054
Molecular Weight 300.289 g/mol
Solvent DMSO-D6
Source File Reference UWCP5152