1-BROMO-2,4,6-TRIISOPROPYLBENZENE(21524-34-5) IR1
Product Name1-BROMO-2,4,6-TRIISOPROPYLBENZENE
CAS21524-34-5
Molecular FormulaC15H23Br
Molecular Weight283.25
InChIInChI=1S/C15H23Br/c1-9(2)12-7-13(10(3)4)15(16)14(8-12)11(5)6/h7-11H,1-6H3
InChIKey FUMMYHVKFAHQST-UHFFFAOYSA-N
SmilesC1(C(C)C)=CC(C(C)C)=CC(C(C)C)=C1Br
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MassMS-NW-6118 2-bromo-1,3,5-triisopropylbenzene C15H23Br (Mass of molecular ion: 282)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 1.0 27.0 8.6 29.0 3.3 39.0 6.1 41.0 22.8 42.0 1.0 43.0 89.4 44.0 3.0 50.0 1.1 51.0 4.3 52.0 1.2 53.0 3.4 55.0 2.6 63.0 3.1 64.0 3.9 65.0 3.8 67.0 1.5 70.0 1.5 70.5 1.5 71.0 3.0 72.0 1.0 75.0 1.5 76.0 2.7 77.0 7.5 77.5 1.0 78.0 2.9 79.0 2.8 89.0 1.4 91.0 14.8 92.0 1.5 102.0 1.5 103.0 2.7 104.0 2.2 105.0 6.5 111.0 1.6 112.0 1.5 115.0 10.4 116.0 4.8 117.0 12.6 118.0 4.2 119.0 4.5 126.0 1.7 127.0 4.3 128.0 10.3 129.0 9.5 130.0 5.7 131.0 8.0 132.0 2.0 133.0 2.1 141.0 4.9 142.0 3.6 143.0 4.8 144.0 3.1 145.0 10.3 146.0 5.4 147.0 1.7 153.0 1.2 155.0 1.3 156.0 1.0 157.0 2.4 158.0 1.1 159.0 6.8 160.0 1.8 169.0 1.9 171.0 1.8 173.0 3.5 175.0 1.2 183.0 2.8 185.0 2.6 187.0 2.1 188.0 1.3 197.0 2.2 199.0 1.8 203.0 8.4 204.0 1.7 211.0 4.0 213.0 3.5 225.0 7.7 226.0 1.2 227.0 6.8 228.0 1.1 239.0 12.7 240.0 2.1 241.0 12.4 242.0 2.0 253.0 5.4 254.0 1.2 255.0 4.9 256.0 1.1 267.0 99.6 268.0 17.8 269.0 100.0 270.0 17.2 271.0 1.5 282.0 43.5 283.0 8.0 284.0 42.4 285.0 7.6
400 MHz in CDCl3
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1H NMR 399.65 MHz C15 H23 Br 0.05 ml : 0.5 ml CDCl3 2-bromo-1,3,5-triisopropylbenzene 
Assign. Shift(ppm)
A 6.985 B 3.487 C 2.862 D 1.242 E 1.240
Hz ppm Int.2791.63 6.986 369 1407.47 3.522 38 1400.63 3.505 94 1393.80 3.488 127 1386.96 3.471 98 1380.13 3.454 41 1151.12 2.881 41 1144.17 2.863 57 1137.21 2.846 44 500.12 1.252 1000 499.15 1.249 842 493.16 1.234 988 492.07 1.232 886
in CDCl3
liquid film
