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4,5,6-triaminopyrimidine, sulfate, hydrate
SpectraBase Compound ID GewWAQD3sje
InChI InChI=1S/C4H7N5/c5-2-3(6)8-1-9-4(2)7/h1H,5H2,(H4,6,7,8,9)
InChIKey MPNBXFXEMHPGTK-UHFFFAOYSA-N
Mol Weight 125.13 g/mol
Molecular Formula C4H7N5
Exact Mass 125.070145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D4EzceJio4C
Name 4,5,6-Pyrimidinetriamine
CAS Registry Number 118-70-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H7N5
InChI InChI=1S/C4H7N5/c5-2-3(6)8-1-9-4(2)7/h1H,5H2,(H4,6,7,8,9)
InChIKey MPNBXFXEMHPGTK-UHFFFAOYSA-N
Molecular Weight 125.135 g/mol
SMILES Nc1c(ncnc1N)N
SPLASH splash10-004i-9700000000-dbd290d6ddf5540faf08
Source of Spectrum W5-1989-26945-1
Synonyms (4,6-diaminopyrimidin-5-yl)amine 4,5,6-Triaminopyrimidine Pyrimidine, 4,5,6-triamino- Pyrimidine-4,5,6-triamine Pyrimidine-4,5,6-triyltriamine EINECS 204-270-2 NSC 145059
Wiley ID 1129284