1-Phenyl-1-propanol(93-54-9) 1H NMR
Product Name1-Phenyl-1-propanol
CAS93-54-9
Molecular FormulaC9H12O
Molecular Weight136.19
InChIInChI=1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3
InChIKey DYUQAZSOFZSPHD-UHFFFAOYSA-N
SmilesC(C1C=CC=CC=1)(O)CC
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MassMS-NW-3395 alpha-ethylbenzyl alcohol C9H12O (Mass of molecular ion: 136)
Source Temperature: 290 °C Sample Temperature: 180 °C Reservoir, 75 eV
27.0 4.4 29.0 3.6 31.0 1.1 39.0 4.0 41.0 1.1 43.0 1.7 50.0 3.8 51.0 9.6 52.0 2.7 53.0 2.0 57.0 2.4 63.0 2.2 65.0 1.8 74.0 1.4 75.0 1.1 77.0 28.9 78.0 7.2 79.0 58.0 80.0 4.3 89.0 1.1 91.0 5.7 103.0 1.5 105.0 5.6 106.0 1.1 107.0 100.0 108.0 7.4 115.0 2.6 117.0 5.4 118.0 3.8 136.0 9.2
90 MHz in CDCl3
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1H NMR 89.56 MHz C9 H12 O 0.04 ml : 0.5 ml CDCl3 alpha-ethylbenzyl alcohol 
Assign. Shift(ppm)
A 7.38 to 7.18 B 4.528 C 2.19 D 1.74 E 0.89
Hz ppm Int.656.13 7.327 51 655.13 7.315 121 653.19 7.294 1000 651.38 7.274 237 649.75 7.255 82 412.25 4.604 41 405.69 4.530 82 399.19 4.458 45 196.38 2.193 104 165.56 1.849 32 164.31 1.835 62 163.56 1.827 47 162.63 1.816 63 157.63 1.761 76 156.63 1.749 102 156.19 1.744 97 155.50 1.737 80 149.88 1.674 94 149.06 1.665 104 142.50 1.592 61 86.00 0.961 194 78.88 0.881 361 71.38 0.798 123 70.63 0.789 74
in CDCl3
liquid film
4880 A,200 M,liquid
