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N,N-dimethyl-2,4-dinitroaniline N-oxide
SpectraBase Compound ID Fu3WnB5DA0i
InChI InChI=1S/C8H9N3O5/c1-11(2,16)8-4-3-6(9(12)13)5-7(8)10(14)15/h3-5H,1-2H3
InChIKey WFMOKMDVRNNPKG-UHFFFAOYSA-N
Mol Weight 227.18 g/mol
Molecular Formula C8H9N3O5
Exact Mass 227.05422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkAEcAlyOfm
Name N,N-dimethyl-2,4-dinitroaniline N-oxide
CAS Registry Number 113509-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9N3O5
InChI InChI=1S/C8H9N3O5/c1-11(2,16)8-4-3-6(9(12)13)5-7(8)10(14)15/h3-5H,1-2H3
InChIKey WFMOKMDVRNNPKG-UHFFFAOYSA-N
Molecular Weight 227.176 g/mol
SMILES c1(N(=O)=O)c([N+]([O-])(C)C)ccc(N(=O)=O)c1
SPLASH splash10-004i-9200000000-6f19bdca853ccf25f299
Source of Spectrum J-53-1893-10
Synonyms 2,4-Dinitrophenyl(dimethyl)amine oxide
Wiley ID 1228344