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(E)-4-methyl-2-(4-nitrobenzylidene)-5-oxopyrazolidin-2-ium-1-ide
SpectraBase Compound ID CHdlOeavzQM
InChI InChI=1S/C11H11N3O3/c1-8-6-13(12-11(8)15)7-9-2-4-10(5-3-9)14(16)17/h2-5,7-8H,6H2,1H3/b13-7+
InChIKey MGSMCCUUWTXJDU-NTUHNPAUSA-N
Mol Weight 233.23 g/mol
Molecular Formula C11H11N3O3
Exact Mass 233.080041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoxicAGuWZW
Name (E)-4-methyl-2-(4-nitrobenzylidene)-5-oxopyrazolidin-2-ium-1-ide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3O3
InChI InChI=1S/C11H11N3O3/c1-8-6-13(12-11(8)15)7-9-2-4-10(5-3-9)14(16)17/h2-5,7-8H,6H2,1H3/b13-7+
InChIKey MGSMCCUUWTXJDU-NTUHNPAUSA-N
Molecular Weight 233.227 g/mol
SMILES C1([N-]\[N+](CC1C)=C/c1ccc([N+]([O-])=O)cc1)=O
SPLASH splash10-0019-9240000000-baf410a2c8119dc374b6
Source of Spectrum JX-2015-0-962
Wiley ID 1720832