N-TRIDECYLBENZENE(123-02-4) MS
Product NameN-TRIDECYLBENZENE
CAS123-02-4
Molecular FormulaC19H32
Molecular Weight260.46
InChIInChI=1S/C19H32/c1-2-3-4-5-6-7-8-9-10-11-13-16-19-17-14-12-15-18-19/h12,14-15,17-18H,2-11,13,16H2,1H3
InChIKey MCVUKOYZUCWLQQ-UHFFFAOYSA-N
SmilesC1(CCCCCCCCCCCCC)=CC=CC=C1
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MassMS-NW-5278 tridecylbenzene C19H32 (Mass of molecular ion: 260)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
27.0 2.5 29.0 6.0 39.0 2.0 41.0 10.3 42.0 1.7 43.0 16.2 55.0 5.7 56.0 1.9 57.0 12.1 65.0 2.8 69.0 2.3 70.0 1.1 71.0 5.3 77.0 1.7 78.0 3.3 79.0 1.9 83.0 1.2 85.0 2.5 91.0 60.2 92.0 100.0 93.0 7.9 94.0 1.1 103.0 1.0 104.0 3.7 105.0 8.8 106.0 2.8 117.0 1.4 119.0 2.6 120.0 1.3 133.0 6.9 134.0 2.1 147.0 1.2 260.0 16.5 261.0 3.8
90 MHz in CDCl3
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1H NMR 89.56 MHz C19 H32 0.04 ml : 0.5 ml CDCl3 tridecylbenzene 
Assign. Shift(ppm)
A 7.44 to 6.96 B 2.58 C 1.60 D 1.26 E 0.88
Hz ppm Int.650.13 7.260 32 647.88 7.235 26 645.75 7.211 170 644.19 7.193 181 640.50 7.152 25 232.94 2.601 40 225.00 2.513 38 124.88 1.395 26 112.50 1.257 1000 83.88 0.937 31 81.50 0.911 25 78.69 0.879 92
in CDCl3
liquid film
4880 A,200 M,liquid
