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2-(3-Nitro-1H-1,2,4-triazol-1-yl)-1-phenylethanone
SpectraBase Compound ID 54ODBhYNFDy
InChI InChI=1S/C10H8N4O3/c15-9(8-4-2-1-3-5-8)6-13-7-11-10(12-13)14(16)17/h1-5,7H,6H2
InChIKey BKXFCLQGXYWHEJ-UHFFFAOYSA-N
Mol Weight 232.2 g/mol
Molecular Formula C10H8N4O3
Exact Mass 232.05964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Azy94atQPvk
Name 2-(3-Nitro-1H-1,2,4-triazol-1-yl)-1-phenylethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N4O3
InChI InChI=1S/C10H8N4O3/c15-9(8-4-2-1-3-5-8)6-13-7-11-10(12-13)14(16)17/h1-5,7H,6H2
InChIKey BKXFCLQGXYWHEJ-UHFFFAOYSA-N
Molecular Weight 232.199 g/mol
SMILES c1(nc[n](n1)CC(=O)c1ccccc1)N(=O)=O
SPLASH splash10-0a4i-7900000000-988fa7dd30ba242f4e46
Synonyms 2-(3-nitro-1,2,4-triazol-1-yl)-1-phenyl-ethanone
Wiley ID 1511088