Isopropylamine(75-31-0) 13C NMR
Product NameIsopropylamine
CAS75-31-0
Molecular FormulaC3H9N
Molecular Weight59.11
InChIInChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3
InChIKey JJWLVOIRVHMVIS-UHFFFAOYSA-N
SmilesCC(N)C
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MassMS-NW-0801 isopropylamine C3H9N (Mass of molecular ion: 59)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 2.2 18.0 11.0 27.0 4.3 28.0 5.1 30.0 1.8 38.0 1.1 39.0 4.5 40.0 2.6 41.0 9.0 42.0 12.0 43.0 5.5 44.0 100.0 45.0 2.6 58.0 8.7 59.0 3.1
90 MHz in CDCl3
parameter neat
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1H NMR 89.56 MHz C3 H9 N 0.02 ml : 0.5 ml CDCl3 isopropylamine 
Assign. Shift(ppm)
A 3.102 B 1.221 C 1.071
Hz ppm Int.290.69 3.246 24 284.38 3.176 55 278.13 3.106 74 271.88 3.036 62 265.69 2.967 31 109.31 1.221 526 105.69 1.181 22 98.94 1.105 1000 96.69 1.080 46 92.69 1.035 906 90.63 1.012 37
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1H NMR 300 MHz C3 H9 N neat isopropylamine Parameter ppm Hz
D(A) 3.04 D(B) 0.99 J(A,B) 6.3 D(C) 1.15 RANFT,J. ANN.PHYS. 10, 1 (1962)
Hz ppm Int.924.70 3.082 29 918.39 3.061 73 912.09 3.040 99 905.79 3.019 76 899.50 2.998 32 345.00 1.150 663 300.13 1.000 1000 293.85 0.979 978
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
