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N-Ethyl-N-methyl-4-nitroaniline
SpectraBase Compound ID EPsZdFQDZNn
InChI InChI=1S/C9H12N2O2/c1-3-10(2)8-4-6-9(7-5-8)11(12)13/h4-7H,3H2,1-2H3
InChIKey IOGXWDULLFRVFZ-UHFFFAOYSA-N
Mol Weight 180.21 g/mol
Molecular Formula C9H12N2O2
Exact Mass 180.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfYdM1DCWWy
Name N-Ethyl-N-methyl-4-nitroaniline
CAS Registry Number 56269-48-8
Comments Note: The molecular formula of the structure shown is C9H12N2O2 - which differs from the formula reported for the mass spectrum (C9H9D3N2O2)
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Formula C9H9D3N2O2
InChI InChI=1S/C9H12N2O2/c1-3-10(2)8-4-6-9(7-5-8)11(12)13/h4-7H,3H2,1-2H3
InChIKey IOGXWDULLFRVFZ-UHFFFAOYSA-N
Molecular Weight 180.207 g/mol
SMILES c1(ccc(cc1)N(CC)C)N(=O)=O
SPLASH splash10-014i-2900000000-c161bb3e8b44b2fbbd35
Synonyms Benzenamine, N-ethyl-N-methyl-4-nitro- Ethyl-methyl-(4-nitrophenyl)amine N-Ethyl-N-methyl-4-nitrobenzeneamine
Wiley ID 1488850