2,3-DICHLOROBENZAL CHLORIDE(57058-14-7) 1H NMR
Product Name2,3-DICHLOROBENZAL CHLORIDE
CAS57058-14-7
Molecular FormulaC7H4Cl4
Molecular Weight229.92
InChIInChI=1S/C7H4Cl4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,7H
InChIKey DGILBEZUEYPVNX-UHFFFAOYSA-N
SmilesC1(=CC=CC(Cl)=C1Cl)C(Cl)Cl
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MassMS-IW-2212 alpha,alpha,2,3-tetrachlorotoluene C7H4Cl4 (Mass of molecular ion: 228)
Source Temperature: 220 °C Sample Temperature: 160 °C Reservoir, 75 eV
36.0 1.7 37.0 1.3 38.0 1.2 39.0 1.6 43.0 3.0 49.0 1.3 50.0 2.1 60.0 2.3 60.5 1.3 61.0 8.0 62.0 6.1 63.0 3.7 72.0 1.2 73.0 8.4 74.0 1.7 75.0 3.2 78.0 2.4 78.5 3.1 79.0 3.3 79.5 2.1 80.0 1.4 83.0 1.1 84.0 1.7 85.0 2.6 86.0 3.6 87.0 4.6 88.0 1.2 96.0 2.9 96.5 5.9 97.0 6.5 97.5 5.6 98.0 1.6 98.5 1.8 99.0 1.9 107.0 2.2 109.0 1.9 123.0 15.4 124.0 1.3 125.0 4.9 133.0 3.7 135.0 2.2 157.0 7.7 158.0 5.0 159.0 5.8 160.0 3.2 161.0 1.3 167.0 1.0 192.0 1.5 193.0 100.0 194.0 9.3 195.0 96.2 196.0 8.0 197.0 31.5 198.0 2.5 199.0 3.4 228.0 13.7 229.0 1.3 230.0 17.4 231.0 1.5 232.0 8.4 234.0 1.8
400 MHz in CDCl3
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1H NMR 399.65 MHz C7 H4 Cl4 0.05 ml : 0.5 ml CDCl3 alpha,alpha,2,3-tetrachlorotoluene 
Assign. Shift(ppm)
A 7.848 B 7.462 C 7.295 D 7.153
Hz ppm Int.3141.36 7.861 352 3139.89 7.857 345 3133.42 7.841 383 3131.84 7.837 363 2987.43 7.476 350 2985.96 7.472 335 2983.76 7.466 23 2979.37 7.455 437 2977.91 7.452 408 2922.85 7.314 371 2914.79 7.294 610 2906.86 7.274 284 2858.64 7.153 1000
in CDCl3
liquid film
