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8-mercaptohypoxanthine, monohydrate
SpectraBase Compound ID JEy56ixnF56
InChI InChI=1S/C5H4N4OS.H2O/c10-4-2-3(6-1-7-4)9-5(11)8-2;/h1H,(H3,6,7,8,9,10,11);1H2
InChIKey QLOURSAHRRTZEF-UHFFFAOYSA-N
Mol Weight 186.189 g/mol
Molecular Formula C5H6N4O2S
Exact Mass 186.021147 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bvsp3KEcIR7
Name 8-mercaptohypoxanthine, monohydrate
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6N4O2S
InChI InChI=1S/C5H4N4OS.H2O/c10-4-2-3(6-1-7-4)9-5(11)8-2;/h1H,(H3,6,7,8,9,10,11);1H2
InChIKey QLOURSAHRRTZEF-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 49865M
Solvent D2O/NaOD