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4,5,6-triaminopyrimidine, sulfate(1:1), hydrate

View entire compound with spectra: 1 NMR, and 2 FTIR

4,5,6-triaminopyrimidine, sulfate(1:1), hydrate
SpectraBase Compound ID 4X3RQhuKp4P
InChI InChI=1S/C4H7N5.H2O4S.H2O/c5-2-3(6)8-1-9-4(2)7;1-5(2,3)4;/h1H,5H2,(H4,6,7,8,9);(H2,1,2,3,4);1H2
InChIKey WRXLIMZODSSQIH-UHFFFAOYSA-N
Mol Weight 241.222 g/mol
Molecular Formula C4H11N5O5S
Exact Mass 241.04809 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID CmYmnUUVZIx
Name 4,5,6-Triaminopyrimidine sulfate salt hydrate
Catalog Number T46000
CAS Registry Number 6640-23-9
Classification 6-membered aromatic heterocycles
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H11N5O5S
InChI InChI=1S/C4H7N5.H2O4S.H2O/c5-2-3(6)8-1-9-4(2)7;1-5(2,3)4;/h1H,5H2,(H4,6,7,8,9);(H2,1,2,3,4);1H2
InChIKey WRXLIMZODSSQIH-UHFFFAOYSA-N
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Pyrimidine, 4,5,6-triamino-, sulfate, hydrate
Technique Mull
Wiley ID SIAL_FTIR_1_10886