2,3-Dinitrotoluene

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Systematic / IUPAC Name: 1-Methyl-2,3-dinitrobenzene

ID: Reference2761

Other Names: 1-Methyl-2,3-dinitro-benzene;
2,3-Dinitrotoluol;
Benzene, 1-methyl-2,3-dinitro-;
Toluene, 2,3-dinitro-;
2,3-DNT

Formula: C7H6N2O4

Class: Industrial Chemicals

Spectral Data

2,3-Dinitrotoluene mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 81
Tandem Spectra MS1, MS2
Ionization Methods APCI
Analyzers FT
Last Modification 6/3/2015 12:12:42 PM
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Identificators

InChI InChI=1S/C7H6N2O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3
InChI Key DYSXLQBUUOPLBB-UHFFFAOYSA-N
Canonical SMILES CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-]
CAS 602017
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Other Names 1-Methyl-2,3-dinitro-benzene;
2,3-Dinitrotoluol;
Benzene, 1-methyl-2,3-dinitro-;
Toluene, 2,3-dinitro-;
2,3-DNT

In Other Databases

PubChem 11761
ChemIDPlus 000602017
Wikipedia Dinitrotoluole (DE)
ChEMBL CHEMBL1531586
ChemSpider 11268