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產(chǎn)品名稱:Α,Α,Α',Α'-四氯鄰二甲苯
CAS:25641-99-0
分子式:C8H6Cl4
分子量: 243.95
InChI:InChI=1S/C8H6Cl4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,7-8H
InChIKey: UFJYKWQUTDGGPV-UHFFFAOYSA-N
Smiles:C1(C(Cl)Cl)=CC=CC=C1C(Cl)Cl
Mass
MS-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
1H NMR | 89.56 MHz |
C8 H6 Cl4 | 0.073 g : 0.5 ml CDCl3 |
alpha,alpha,alpha',alpha'-tetrachloro-o-xylene |
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Assign. Shift(ppm) |
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
Α,Α,Α',Α'-四氯鄰二甲苯(25641-99-0)核磁圖(13CNMR)相關(guān)產(chǎn)品圖譜