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2-Pyrazinamine 4-oxide
SpectraBase Compound ID L9OubjTFl2K
InChI InChI=1S/C4H5N3O/c5-4-3-7(8)2-1-6-4/h1-3H,(H2,5,6)
InChIKey RNJSCNQGWWUIOG-UHFFFAOYSA-N
Mol Weight 111.1 g/mol
Molecular Formula C4H5N3O
Exact Mass 111.043262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JHh8co2XGK
Name 2-Pyrazinamine 4-oxide
Alternate Name(s) 3-Aminopyrazine 1-oxide 4-Oxido-2-pyrazin-4-iumamine 4-Oxidopyrazin-4-ium-2-amine 4-Oxidanidylpyrazin-4-ium-2-amine
CAS Registry Number 6863-77-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5N3O
InChI InChI=1S/C4H5N3O/c5-4-3-7(8)2-1-6-4/h1-3H,(H2,5,6)
InChIKey RNJSCNQGWWUIOG-UHFFFAOYSA-N
Molecular Weight 111.104 g/mol
SMILES Nc1cn(ccn1)=O
SPLASH splash10-03di-8900000000-ca0bce776bc5230f26c2
Source of Spectrum NP-0-3205-0
Wiley ID 1095326