1,3-DIPHENYLPROPANE(1081-75-0) IR1
Product Name1,3-DIPHENYLPROPANE
CAS1081-75-0
Molecular FormulaC15H16
Molecular Weight196.29
InChIInChI=1S/C15H16/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey VEAFKIYNHVBNIP-UHFFFAOYSA-N
SmilesC(C1=CC=CC=C1)CCC1=CC=CC=C1
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MassMS2016-05358CM 1,3-diphenylpropane C15H16 (Mass of molecular ion: 196)
Source Temperature: 245 °C Sample Temperature: 20 °C Direct, 70 eV
27.0 3.8 39.0 8.7 41.0 2.8 50.0 2.7 51.0 9.2 52.0 2.3 53.0 1.3 62.0 1.0 63.0 4.6 64.0 1.2 65.0 16.3 66.0 1.1 76.0 1.1 77.0 16.0 78.0 6.4 79.0 10.8 89.0 3.0 90.0 1.0 91.0 59.9 92.0 100.0 93.0 7.3 102.0 1.2 103.0 8.2 104.0 11.1 105.0 45.4 106.0 4.1 115.0 2.6 117.0 3.6 118.0 3.0 165.0 1.0 196.0 44.1 197.0 7.1
90 MHz in CDCl3
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1H NMR 89.56 MHz C15 H16 0.04 ml : 0.5 ml CDCl3 1,3-diphenylpropane 
Assign. Shift(ppm)
A 7.43 to 7.00 B 2.64 C 1.97
Hz ppm Int.661.81 7.390 30 658.81 7.357 70 657.69 7.344 42 656.19 7.327 50 655.63 7.321 46 653.63 7.299 69 651.19 7.271 193 648.38 7.240 188 646.50 7.219 949 645.00 7.202 1000 641.31 7.161 138 639.63 7.142 87 638.75 7.133 99 637.44 7.118 100 632.13 7.059 43 245.00 2.736 109 244.25 2.728 115 237.38 2.651 266 229.81 2.566 219 190.00 2.122 46 188.44 2.105 44 183.56 2.050 69 182.44 2.038 47 181.88 2.031 54 180.81 2.019 86 177.06 1.977 42 174.56 1.950 87 173.00 1.932 68 171.50 1.915 35 168.69 1.884 41 167.50 1.871 33 166.25 1.857 40 165.19 1.845 42
in CDCl3
liquid film
4880 A,200 M,liquid
