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Benzamide, N-(5-amino-1H-1,2,4-triazol-3-yl)-4-nitro-
SpectraBase Compound ID DKIzfuhfa0d
InChI InChI=1S/C9H8N6O3/c10-8-12-9(14-13-8)11-7(16)5-1-3-6(4-2-5)15(17)18/h1-4H,(H4,10,11,12,13,14,16)
InChIKey ONYOHIIFGAHZFG-UHFFFAOYSA-N
Mol Weight 248.2 g/mol
Molecular Formula C9H8N6O3
Exact Mass 248.065788 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzijzwaryWu
Name Benzamide, N-(5-amino-1H-1,2,4-triazol-3-yl)-4-nitro-
Alternate Name(s) 3-Amino-5-(4'-nitrobenzamido)-1,2,4-triazole N-(5-amino-1H-1,2,4-triazol-3-yl)-4-nitrobenzamide
CAS Registry Number 80616-61-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N6O3
InChI InChI=1S/C9H8N6O3/c10-8-12-9(14-13-8)11-7(16)5-1-3-6(4-2-5)15(17)18/h1-4H,(H4,10,11,12,13,14,16)
InChIKey ONYOHIIFGAHZFG-UHFFFAOYSA-N
Molecular Weight 248.202 g/mol
SMILES N(c1nc([nH]n1)N)C(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-0udi-5920000000-ea12354eaba409346242
Source of Spectrum 0-16-374-1
Wiley ID 1250419