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4-Amino-2,6-dinitrotoluene
SpectraBase Compound ID 3qo4PRTJuSI
InChI InChI=1S/C7H7N3O4/c1-4-6(9(11)12)2-5(8)3-7(4)10(13)14/h2-3H,8H2,1H3
InChIKey KQRJATLINVYHEZ-UHFFFAOYSA-N
Mol Weight 197.15 g/mol
Molecular Formula C7H7N3O4
Exact Mass 197.043656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FY5jA9f9dzr
Name Benzenamine, 4-methyl-3,5-dinitro-
Alternate Name(s) p-Toluidine, 3,5-dinitro- 4-Methyl-3,5-dinitroaniline (4-methyl-3,5-dinitro-phenyl)amine 3,5-Dinitro-4-methylaniline 3,5-Dinitro-p-toluidine 4-ADNT 4-Amino-2,6-dinitrotoluene 4-Methyl-3,5-dinitrobenzenamine Benzenamine, 3,5-dinitro-4-methyl- AI3-23207 BRN 2462150 CCRIS 5190 NSC 25010
CAS Registry Number 19406-51-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7N3O4
InChI InChI=1S/C7H7N3O4/c1-4-6(9(11)12)2-5(8)3-7(4)10(13)14/h2-3H,8H2,1H3
InChIKey KQRJATLINVYHEZ-UHFFFAOYSA-N
Molecular Weight 197.150 g/mol
SMILES Nc1cc(N(=O)=O)c(C)c(N(=O)=O)c1
SPLASH splash10-0fbc-7900000000-99079c2dd4bd21821fe9
Source of Spectrum KO-11-596-0
Wiley ID 1194220