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Pyrazinamine, 5-bromo-
SpectraBase Compound ID 8BZHO35kAsd
InChI InChI=1S/C4H4BrN3/c5-3-1-8-4(6)2-7-3/h1-2H,(H2,6,8)
InChIKey KRRTXVSBTPCDOS-UHFFFAOYSA-N
Mol Weight 174.0 g/mol
Molecular Formula C4H4BrN3
Exact Mass 172.95886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MOAgXuxbGD
Name Pyrazinamine, 5-bromo-
CAS Registry Number 59489-71-3
Comments Less than 3 mono-isotopic peaks
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Formula C4H4BrN3
InChI InChI=1S/C4H4BrN3/c5-3-1-8-4(6)2-7-3/h1-2H,(H2,6,8)
InChIKey KRRTXVSBTPCDOS-UHFFFAOYSA-N
Molecular Weight 174.001 g/mol
SMILES Nc1ncc(nc1)Br
SPLASH splash10-0092-0900000000-02034afaf93baed54148
Source of Spectrum Y-19-674-0
Synonyms 5-Bromo-2-pyrazinamine (5-bromopyrazin-2-yl)amine 2-Amino-5-bromopyrazine 5-bromanylpyrazin-2-amine 5-Bromo-2-aminopyrazine 5-bromopyrazin-2-amine
Wiley ID 1169561