Product Name2,6-DIAMINOPIMELIC ACID
CAS583-93-7
Molecular FormulaC7H14N2O4
Molecular Weight190.2
InChIInChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
InChIKey GMKMEZVLHJARHF-UHFFFAOYSA-N
SmilesC(O)(=O)C(N)CCCC(N)C(O)=O

Mass
MS-NW-2014 2,6-diaminopimelic acid C7H14N2O4 (H2O) (Mass of molecular ion: 190)
Source Temperature: 210 °C Sample Temperature: 240 °C Direct, 75 eV
20.0 2.0
22.0 1.9
25.0 1.2
26.0 6.6
27.0 23.9
28.0 38.9
29.0 10.7
30.0 18.6
36.0 2.2
37.0 1.6
38.0 3.4
39.0 18.8
40.0 5.9
41.0 29.3
42.0 13.7
43.0 24.5
44.0 100.0
45.0 3.5
46.0 1.3
50.0 3.8
51.0 7.6
52.0 9.3
53.0 11.4
54.0 27.7
55.0 40.5
56.0 74.2
57.0 14.5
58.0 2.0
59.0 1.2
62.0 1.0
63.0 1.7
64.0 1.3
65.0 3.6
66.0 4.4
67.0 9.3
68.0 14.1
69.0 12.0
70.0 13.2
71.0 7.9
72.0 6.4
73.0 2.3
74.0 3.4
75.0 1.6
76.0 1.0
77.0 1.8
78.0 4.1
79.0 9.0
80.0 13.2
81.0 11.0
82.0 45.1
83.0 32.5
84.0 13.6
85.0 1.5
86.0 1.0
89.0 1.1
90.0 1.4
91.0 4.1
92.0 2.4
93.0 5.3
94.0 3.8
95.0 2.8
96.0 3.1
97.0 4.6
98.0 3.7
99.0 3.7
100.0 2.2
102.0 1.2
103.0 2.1
104.0 2.1
105.0 1.5
106.0 1.6
107.0 2.2
108.0 3.7
109.0 7.4
110.0 5.0
111.0 9.5
112.0 1.7
115.0 1.4
116.0 1.3
118.0 2.1
119.0 1.0
121.0 1.2
122.0 1.5
123.0 1.6
124.0 1.3
125.0 1.1
126.0 5.3
127.0 12.4
128.0 18.3
129.0 5.1
133.0 1.1
134.0 1.0
136.0 2.0
137.0 1.2
143.0 2.5
144.0 1.5
145.0 1.8
148.0 1.6
149.0 1.0
150.0 1.1
151.0 1.7
154.0 8.5
155.0 1.3
164.0 1.2
167.0 2.4
172.0 3.7
182.0 1.3
400 MHz in D2O

| 1H NMR | 399.65 MHz |
| C7 H14 N2 O4 | saturated in D2O |
| 2,6-diaminopimelic acid | |
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Assign. Shift(ppm) |
Hz ppm Int.
1519.04 3.801 383
1513.06 3.786 832
1507.08 3.771 486
1506.10 3.769 496
1500.24 3.754 421
1499.27 3.752 544
1493.65 3.738 365
781.25 1.955 339
780.88 1.954 340
777.83 1.947 317
772.71 1.934 639
771.36 1.931 1000
767.09 1.920 607
764.65 1.914 734
761.72 1.906 315
760.74 1.904 292
758.30 1.898 498
754.52 1.888 207
753.17 1.885 200
597.41 1.495 192
595.70 1.491 227
595.34 1.490 216
594.12 1.487 164
593.63 1.486 163
589.72 1.476 340
585.08 1.464 176
584.72 1.464 177
584.23 1.462 177
583.62 1.461 179
582.64 1.458 169
582.28 1.457 169
581.79 1.456 168
580.69 1.453 166
579.83 1.451 163
in D2O

KBr disc

nujol mull

2,6-DIAMINOPIMELIC ACID(583-93-7) 1H NMR Atlas of Related Products
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