甘氨酸乙酯鹽酸鹽(623-33-6)核磁圖(1HNMR)
分子式:C4H9NO2.ClH
分子量: 139.58
InChI:InChI=1S/C4H9NO2.ClH/c1-2-7-4(6)3-5;/h2-3,5H2,1H3;1H
InChIKey: TXTWXQXDMWILOF-UHFFFAOYSA-N
Smiles:C(=O)(CN)OCC.Cl
-
Mass
MS-NW-0503
glycine ethyl ester hydrochloride
C4H9NO2 HCl (Mass of molecular ion: 103)
Source Temperature: 200 °C
Sample Temperature: 140 °C
Direct, 75 eV
27.0 2.9
28.0 6.0
29.0 4.9
30.0 100.0
31.0 1.9
35.0 1.8
36.0 17.7
38.0 5.6
60.0 2.0
103.0 3.0
90 MHz in D2O
400 MHz in D2O
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| 1H NMR |
89.56 MHz |
| C4 H9 N O2
|
0.046 g : 0.5 ml D2O
|
| glycine ethyl ester hydrochloride
|
 |
Assign. Shift(ppm)
B 4.309
C 3.929
D 1.299
THE SOLVENT SIGNAL REMOVED.
|
Hz ppm Int.
396.94 4.433 117
389.75 4.352 351
386.44 4.315 25
382.56 4.272 367
375.44 4.193 128
351.94 3.930 1000
123.38 1.378 427
121.00 1.352 35
116.25 1.299 833
112.94 1.262 37
112.50 1.257 38
109.13 1.219 387
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| 1H NMR |
399.65 MHz |
| C4 H9 N O2
|
0.038 g : 0.5 ml D2O
|
| glycine ethyl ester hydrochloride
|
|
Assign. Shift(ppm)
A 4.300
B 3.919
C 1.290
THE SOLVENT PEAK SUPPRESSED.
|
Hz ppm Int.
1729.25 4.327 130
1722.17 4.310 386
1714.97 4.292 390
1707.76 4.274 135
1566.41 3.920 1000
522.46 1.308 437
515.26 1.290 848
508.18 1.272 417