1,2-BIS(DICHLOROMETHYL)BENZENE(25641-99-0) 1H NMR
Product Name1,2-BIS(DICHLOROMETHYL)BENZENE
CAS25641-99-0
Molecular FormulaC8H6Cl4
Molecular Weight243.95
InChIInChI=1S/C8H6Cl4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,7-8H
InChIKey UFJYKWQUTDGGPV-UHFFFAOYSA-N
SmilesC1(C(Cl)Cl)=CC=CC=C1C(Cl)Cl
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MassMS-NW-7756 alpha,alpha,alpha',alpha'-tetrachloro-o-xylene C8H6Cl4 (Mass of molecular ion: 242)
Source Temperature: 130 °C Sample Temperature: 100 °C Direct, 75 eV
36.0 2.1 37.0 1.5 38.0 1.9 39.0 3.0 49.0 2.0 49.5 1.2 50.0 12.1 50.5 1.0 51.0 11.4 52.0 1.7 61.0 2.2 62.0 3.6 63.0 5.1 67.0 1.4 68.0 12.6 68.5 1.5 69.0 4.7 73.0 3.0 74.0 5.7 75.0 10.9 76.0 3.6 77.0 2.2 84.0 1.2 85.0 5.0 86.0 12.7 86.5 1.3 87.0 7.9 88.0 1.6 89.0 1.5 97.0 1.4 98.0 1.7 99.0 3.5 100.0 1.6 101.0 15.5 102.0 13.2 103.0 3.0 104.0 2.2 109.0 1.2 111.0 1.0 135.0 2.6 136.0 10.0 137.0 20.2 138.0 6.0 139.0 6.6 159.0 1.7 161.0 1.1 171.0 5.9 172.0 32.6 173.0 10.3 174.0 21.4 175.0 5.3 176.0 3.9 206.0 4.8 207.0 100.0 208.0 13.9 209.0 96.0 210.0 10.9 211.0 30.6 212.0 3.1 213.0 3.8 241.0 1.4 242.0 14.6 243.0 2.8 244.0 18.3 245.0 2.3 246.0 9.1 247.0 1.0 248.0 2.0
90 MHz in CDCl3
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1H NMR 89.56 MHz C8 H6 Cl4 0.073 g : 0.5 ml CDCl3 alpha,alpha,alpha',alpha'-tetrachloro-o-xylene 
Assign. Shift(ppm)
A 7.69 B 7.45 C 7.175
Hz ppm Int.695.63 7.768 175 692.19 7.729 199 690.19 7.707 171 689.38 7.698 141 686.56 7.666 289 686.13 7.662 266 682.63 7.623 75 674.19 7.528 87 670.44 7.486 303 667.25 7.451 184 666.50 7.442 163 664.50 7.420 197 661.00 7.381 173 642.63 7.176 1000
in CDCl3
KBr disc
nujol mull
4880 A,200 M,powder
