1,4-Dinitrosobenzene(105-12-4) IR2
Product Name1,4-Dinitrosobenzene
CAS105-12-4
Molecular FormulaC6H4N2O2
Molecular Weight136.11
InChIInChI=1S/C6H4N2O2/c9-7-5-1-2-6(8-10)4-3-5/h1-4H
InChIKey MKZXROSCOHNKDX-UHFFFAOYSA-N
SmilesC1(N=O)=CC=C(N=O)C=C1
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MassMS-NW-1441 p-dinitrosobenzene C6H4N2O2 (Mass of molecular ion: 136)
Source Temperature: 250 °C Sample Temperature: 170 °C Reservoir, 75 eV
14.0 1.0 16.0 1.3 17.0 4.0 18.0 17.4 26.0 2.3 27.0 1.8 28.0 1.9 29.0 2.4 30.0 24.5 37.0 5.8 38.0 5.9 39.0 5.3 43.0 1.8 44.0 11.6 49.0 1.9 50.0 52.5 51.0 8.8 52.0 3.6 53.0 1.3 61.0 3.1 62.0 4.2 63.0 8.1 64.0 7.2 65.0 2.9 73.0 2.6 74.0 14.7 75.0 26.4 76.0 100.0 77.0 7.8 78.0 1.2 90.0 1.4 92.0 7.9 106.0 32.3 107.0 2.7 122.0 10.3 123.0 1.0 136.0 66.4 137.0 5.1 138.0 2.3 152.0 7.9 168.0 11.9
90 MHz in CDCl3
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1H NMR 89.56 MHz C6 H4 N2 O2 0.044 g : 0.5 ml CDCl3 p-dinitrosobenzene 
Assign. Shift(ppm)
A 8.43
Hz ppm Int.758.38 8.468 24 754.81 8.428 1000
in CDCl3
KBr disc
nujol mull
