異丙胺(75-31-0)質(zhì)譜(MS)
InChI:InChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3
InChIKey: JJWLVOIRVHMVIS-UHFFFAOYSA-N
Smiles:CC(N)C
-
Mass
MS-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
-
| 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
-
| 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