Molecular FormulaC4H10O
Molecular Weight74.12
InChIInChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3
InChIKey BTANRVKWQNVYAZ-UHFFFAOYSA-N
SmilesCC(O)CC
Mass
MS2014-05098CW 2-butanol C4H10O (Mass of molecular ion: 74)
Source Temperature: 250 °C Sample Temperature: 250 °C Reservoir, 70 eV
15.0 1.7 19.0 1.3 26.0 2.2 27.0 10.4 28.0 7.4 29.0 5.5 31.0 12.5 32.0 2.0 38.0 1.1 39.0 7.4 40.0 1.3 41.0 19.6 42.0 1.8 43.0 12.2 44.0 7.1 45.0 100.0 46.0 2.3 50.0 1.6 51.0 1.4 53.0 1.8 55.0 6.2 56.0 7.8 57.0 4.3 59.0 29.6 60.0 1.1 73.0 2.6
90 MHz in CDCl3
in CDCl3
1H NMR | 89.56 MHz |
C4 H10 O | 11.2 mol% in CDCl3 |
2-butanol |
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Assign. Shift(ppm) |
Hz ppm Int.
341.69 3.816 70 335.56 3.747 143 329.44 3.679 151 323.25 3.610 81 212.06 2.368 845 141.69 1.583 40 139.44 1.557 128 138.25 1.544 80 135.25 1.511 32 133.25 1.488 125 132.00 1.474 146 131.44 1.468 186 127.81 1.428 40 125.19 1.398 237 119.06 1.330 70 118.19 1.320 61 108.13 1.208 1000 105.94 1.183 37 101.94 1.139 956 90.19 1.008 197 89.38 0.998 306 82.75 0.924 514 80.88 0.904 145 75.63 0.845 107 74.75 0.835 154 73.38 0.820 96
in CDCl3
CCl4 solution
liquid film
4880 A,100M,liquid
2-Butanol(78-92-2) 1H NMR Atlas of Related Products
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