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4,5,6-Triaminopyrimidine-2-sulfinic acid
SpectraBase Compound ID JHqEjl3WCxZ
InChI InChI=1S/C4H7N5O2S/c5-1-2(6)8-4(12(10)11)9-3(1)7/h5H2,(H,10,11)(H4,6,7,8,9)
InChIKey REIWROFKCFSJNV-UHFFFAOYSA-N
Mol Weight 189.19 g/mol
Molecular Formula C4H7N5O2S
Exact Mass 189.032046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Imcb0zyPWY7
Name 4,5,6-Triaminopyrimidine-2-sulfinic acid
Alternate Name(s) 4,5,6-Triamino-2-pyrimidinesulfinic acid 4,5,6-tris(azanyl)pyrimidine-2-sulfinic acid
CAS Registry Number 98022-70-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H7N5O2S
InChI InChI=1S/C4H7N5O2S/c5-1-2(6)8-4(12(10)11)9-3(1)7/h5H2,(H,10,11)(H4,6,7,8,9)
InChIKey REIWROFKCFSJNV-UHFFFAOYSA-N
Molecular Weight 189.193 g/mol
SMILES Nc1c(c(nc(n1)S(=O)O)N)N
SPLASH splash10-004i-9200000000-7d701c25a34ad2bdcc77
Wiley ID 1480547