(R)-(-)-2-Pentanol(31087-44-2) 13C NMR
Product Name(R)-(-)-2-Pentanol
CAS31087-44-2
Molecular FormulaC5H12O
Molecular Weight88.15
InChIInChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3/t5-/m1/s1
InChIKey JYVLIDXNZAXMDK-RXMQYKEDSA-N
SmilesC[C@@H](O)CCC
-
MassMS-NW-5345 (R)-(-)-2-pentanol C5H12O (Mass of molecular ion: 88)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 2.0 18.0 2.2 19.0 2.5 27.0 8.8 28.0 1.2 29.0 4.5 31.0 5.3 39.0 4.6 41.0 6.2 42.0 2.8 43.0 10.6 44.0 7.2 45.0 100.0 46.0 2.3 55.0 19.7 70.0 1.5 73.0 7.7
90 MHz in CDCl3
-
1H NMR 89.56 MHz C5 H12 O 0.04 ml : 0.5 ml CDCl3 (R)-(-)-2-pentanol 
Assign. Shift(ppm)
A 3.80 B 1.81 C 1.44 D 1.37 E 1.181 F 0.94
Hz ppm Int.343.75 3.839 43 339.31 3.789 30 337.69 3.771 48 162.00 1.809 110 133.69 1.493 43 133.13 1.487 49 130.81 1.461 108 129.63 1.448 134 128.88 1.440 150 128.38 1.434 141 127.44 1.423 161 126.88 1.417 138 126.25 1.410 126 125.06 1.397 137 124.38 1.389 145 123.06 1.375 168 121.56 1.358 108 118.56 1.324 69 117.06 1.308 48 115.44 1.289 42 113.94 1.273 47 110.81 1.238 31 108.75 1.215 1000 102.56 1.146 943 100.31 1.121 37 92.00 1.028 38 90.44 1.010 56 89.50 1.000 83 88.75 0.991 88 87.25 0.975 74 85.94 0.960 100 85.00 0.950 94 83.13 0.929 207 80.63 0.901 84 79.94 0.893 89 79.06 0.883 77 78.56 0.878 80 77.06 0.861 33 75.69 0.846 39
in CDCl3
liquid film
4880 A,200 M,liquid
