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4,6-Diamino-2-mercaptopyrimidine hydrate

View entire compound with spectra: 1 FTIR, and 1 Raman

4,6-Diamino-2-mercaptopyrimidine hydrate
SpectraBase Compound ID BHTNAnFmj0r
InChI InChI=1S/C4H6N4S.H2O/c5-2-1-3(6)8-4(9)7-2;/h1H,(H5,5,6,7,8,9);1H2
InChIKey SHPHVYKOHUSHAU-UHFFFAOYSA-N
Mol Weight 158.18 g/mol
Molecular Formula C4H6N4OS
Exact Mass 158.026232 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID CMMuu6IZLDX
Name 4,6-Diamino-2-mercaptopyrimidine hydrate
Catalog Number 125830
Brand ALDRICH
CAS Registry Number 1004-39-3
Copyright Copyright © 2017-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H8N4OS
Formula (reported) C4H8N4OS
InChI InChI=1S/C4H6N4S.H2O/c5-2-1-3(6)8-4(9)7-2;/h1H,(H5,5,6,7,8,9);1H2
InChIKey SHPHVYKOHUSHAU-UHFFFAOYSA-N
Purity 99%
Synonyms 4,6-Diamino-2-pyrimidinethiol
Wiley ID SIAL_RAMAN_000812