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N-(4-acetylphenyl)-4-bromo-3-nitro-1H-pyrazole-5-carboxamide
SpectraBase Compound ID 4A7JVDuwAaX
InChI InChI=1S/C12H9BrN4O4/c1-6(18)7-2-4-8(5-3-7)14-12(19)10-9(13)11(16-15-10)17(20)21/h2-5H,1H3,(H,14,19)(H,15,16)
InChIKey XKQPGSKOUOSSQC-UHFFFAOYSA-N
Mol Weight 353.13 g/mol
Molecular Formula C12H9BrN4O4
Exact Mass 351.980718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzKbmiaLHd9
Name N-(4-acetylphenyl)-4-bromo-3-nitro-1H-pyrazole-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrN4O4
InChI InChI=1S/C12H9BrN4O4/c1-6(18)7-2-4-8(5-3-7)14-12(19)10-9(13)11(16-15-10)17(20)21/h2-5H,1H3,(H,14,19)(H,15,16)
InChIKey XKQPGSKOUOSSQC-UHFFFAOYSA-N
Molecular Weight 353.132 g/mol
SMILES N(C(c1c(c(n[nH]1)N(=O)=O)Br)=O)c1ccc(C(=O)C)cc1
SPLASH splash10-0a4i-9707000000-3b0692f8329b4c8620b1
Source of Spectrum IY-2-4869-6
Wiley ID 1656453