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2,4-Dinitrotoluene
SpectraBase Compound ID cqS8OhMqpg
InChI InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3
InChIKey RMBFBMJGBANMMK-UHFFFAOYSA-N
Mol Weight 182.13 g/mol
Molecular Formula C7H6N2O4
Exact Mass 182.032757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bUcKUfaim
Name Benzene, 1-methyl-2,4-dinitro-
Alternate Name(s) 1-Methyl-2,4-Dinitrobenzene 1-Methyl-2,4-dinitro-benzene 2,4-Dinitro-1-methylbenzene 2,4-Dinitromethylbenzene 2,4-Dinitrotoluene 2,4-Dinitrotoluol 2,4-DNT 4-Methyl-1,3-dinitrobenzene Dinitrotoluol Toluene, 2,4-dinitro- AI3-15342 CCRIS 268 EINECS 204-450-0 HSDB 1144 NCI-C01865 NSC 7194 RCRA WASTE NO. U105
CAS Registry Number 121-14-2
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Formula C7H6N2O4
InChI InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3
InChIKey RMBFBMJGBANMMK-UHFFFAOYSA-N
Molecular Weight 182.135 g/mol
SMILES Cc1ccc(cc1N(=O)=O)N(=O)=O
SPLASH splash10-029i-9200000000-3a351bc9bf2e486bc8d7
Source of Spectrum JX-2012-896
Wiley ID 1661342