DIALLYL ISOPHTHALATE(1087-21-4) IR1
Product NameDIALLYL ISOPHTHALATE
CAS1087-21-4
Molecular FormulaC14H14O4
Molecular Weight246.26
InChIInChI=1S/C14H14O4/c1-3-8-17-13(15)11-6-5-7-12(10-11)14(16)18-9-4-2/h3-7,10H,1-2,8-9H2
InChIKey OOORLLSLMPBSPT-UHFFFAOYSA-N
SmilesC1(C(OCC=C)=O)=CC=CC(C(OCC=C)=O)=C1
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MassMS-NW-0317 diallyl isophthalate C14H14O4 (Mass of molecular ion: 246)
Source Temperature: 150 °C Sample Temperature: 115 °C Direct, 75 eV
39.0 4.9 41.0 11.8 50.0 2.4 57.0 1.0 65.0 1.9 75.0 2.0 76.0 7.5 77.0 1.4 91.0 2.5 103.0 2.3 104.0 4.5 105.0 1.2 115.0 6.4 116.0 1.8 117.0 2.9 121.0 1.5 149.0 9.6 189.0 100.0 190.0 12.6 191.0 2.8 246.0 13.3 247.0 1.9
90 MHz in CDCl3
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1H NMR 89.56 MHz C14 H14 O4 0.04 ml : 0.5 ml CDCl3 diallyl isophthalate 
Assign. Shift(ppm)
A 8.729 B 8.249 C 7.546 D 6.039 E 5.43 F 5.32 G 4.857
Hz ppm Int.783.88 8.753 173 783.31 8.747 183 782.13 8.734 377 781.56 8.727 367 780.38 8.714 239 779.81 8.708 206 744.25 8.311 348 743.81 8.306 363 742.56 8.292 323 742.00 8.285 320 736.13 8.220 476 734.44 8.201 490 682.81 7.625 230 682.25 7.618 219 675.50 7.543 202 674.94 7.537 239 674.00 7.526 177 667.25 7.451 144 666.69 7.445 140 563.19 6.289 86 557.50 6.225 177 553.06 6.176 119 552.00 6.164 113 547.50 6.114 208 546.06 6.098 156 542.06 6.053 133 540.31 6.033 271 535.94 5.985 206 534.88 5.973 191 530.19 5.920 333 524.88 5.861 245 495.81 5.537 165 494.31 5.520 434 492.69 5.502 595 491.31 5.486 261 482.19 5.384 215 481.00 5.371 478 479.75 5.357 328 479.31 5.352 383 478.63 5.345 221 478.19 5.340 217 477.19 5.329 316 475.63 5.311 311 474.13 5.294 150 472.13 5.272 142 470.88 5.258 318 469.25 5.240 313 468.06 5.227 170 438.94 4.902 636 437.69 4.888 1000 436.38 4.873 620 433.44 4.840 531 432.13 4.826 992 430.81 4.811 586
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
