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Details
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This molecule without stereoconfiguration:
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ChiuZ/Chloroform-D1 (CDCl3)
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Type: 13C 150.0   Double click to get resizeable window!
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Atom
No.
⇓
|
Mult.(coupling const.) |
Meas.
Shift
|
|
1
|
S |
151.2 |
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2
|
S |
141.7 |
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3
|
S |
153.6 |
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4
|
D |
107.4 |
|
5
|
T |
29.9 |
|
6
|
T |
36.5 |
|
7
|
D |
52.7 |
|
8
|
D |
130.5 |
|
9
|
S |
179.5 |
|
10
|
S |
164.1 |
|
11
|
D |
112.9 |
|
12
|
D |
135.6 |
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13
|
Q |
61.6 |
|
14
|
Q |
61.4 |
|
15
|
Q |
56.2 |
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16
|
Q |
22.8 |
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16
|
Q |
56.5 |
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17
|
S |
170.1 |
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4a
|
S |
134.3 |
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7a
|
S |
152.6 |
|
12a
|
S |
137.0 |
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12b
|
S |
125.6 |
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Show spectrum in full size
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Type: 1H 600.0 Double click to get resizeable window!
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Atom
No.
⇓
|
Mult.(coupling const.) |
Meas.
Shift
|
|
18-H
|
|
|
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4-H
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|
6.550 |
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5-H
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2.390, 2.520 |
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6-H
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1.956, 2.350 |
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7-H
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4.660 |
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8-H
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|
7.630 |
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11-H
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(10.9) |
6.900 |
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12-H
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(10.9) |
7.356 |
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13-H
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3.660 |
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14-H
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|
3.940 |
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15-H
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|
3.910 |
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16-H
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|
1.970 |
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16-H
|
|
4.010 |
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Show spectrum in full size
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Type: H,C-HSQC 600.0 Double click to get resizeable window!
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Axis: 1 (H) |
Axis: 2 (C) |
Atom
|
Shift
|
Shift
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6
|
1.95 |
36.5 |
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16
|
1.97 |
22.8 |
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6
|
2.35 |
36.5 |
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5
|
2.39 |
29.9 |
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5
|
2.52 |
29.9 |
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13
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3.66 |
61.6 |
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15
|
3.91 |
56.2 |
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14
|
3.94 |
61.4 |
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16
|
4.01 |
56.5 |
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7
|
4.65 |
52.7 |
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4
|
6.53 |
107.4 |
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11
|
6.9 |
112.9 |
|
12
|
7.36 |
135.6 |
|
8
|
7.63 |
130.5 |
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Show spectrum in full size
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Type: H,C-HMBC 600.0 Double click to get resizeable window!
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|
Axis: 1 (H) |
Axis: 2 (C) |
Atom
|
Shift
|
Atom
|
Shift
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|
|
6
|
1.95 |
5
|
29.9 |
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6
|
1.95 |
7
|
52.7 |
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6
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1.95 |
4a
|
134.3 |
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16
|
1.97 |
17
|
170.1 |
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6
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2.35 |
5
|
29.9 |
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6
|
2.35 |
7
|
52.7 |
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6
|
2.35 |
7a
|
152.6 |
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5
|
2.39 |
4a
|
134.3 |
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5
|
2.39 |
12b
|
125.6 |
|
5
|
2.39 |
4
|
107.4 |
|
5
|
2.39 |
6
|
36.5 |
|
5
|
2.52 |
6
|
36.5 |
|
5
|
2.52 |
7
|
52.7 |
|
5
|
2.52 |
4
|
107.4 |
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5
|
2.52 |
12b
|
125.6 |
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5
|
2.52 |
4a
|
134.3 |
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13
|
3.66 |
1
|
151.2 |
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15
|
3.91 |
3
|
153.6 |
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14
|
3.94 |
2
|
141.7 |
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16
|
4.01 |
10
|
164.1 |
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16
|
4.01 |
11
|
112.9 |
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7
|
4.65 |
7a
|
152.6 |
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7
|
4.65 |
6
|
36.5 |
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7
|
4.65 |
8
|
130.5 |
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7
|
4.65 |
12a
|
137.0 |
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7
|
4.65 |
17
|
170.1 |
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4
|
6.53 |
5
|
29.9 |
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4
|
6.53 |
12b
|
125.6 |
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4
|
6.53 |
2
|
141.7 |
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4
|
6.53 |
1
|
151.2 |
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4
|
6.53 |
3
|
153.6 |
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4
|
6.53 |
4a
|
134.3 |
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11
|
6.9 |
12a
|
137.0 |
|
11
|
6.9 |
10
|
164.1 |
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11
|
6.9 |
9
|
179.5 |
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12
|
7.36 |
12b
|
125.6 |
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12
|
7.36 |
12a
|
137.0 |
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12
|
7.36 |
7a
|
152.6 |
|
12
|
7.36 |
10
|
164.1 |
|
8
|
7.63 |
7
|
52.7 |
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Axis: 1 (H) |
Axis: 2 (C) |
Atom
|
Shift
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Atom
|
Shift
|
|
|
8
|
7.63 |
12a
|
137.0 |
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8
|
7.63 |
7a
|
152.6 |
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8
|
7.63 |
10
|
164.1 |
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8
|
7.63 |
9
|
179.5 |
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18
|
8.12 |
7
|
52.7 |
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18
|
8.12 |
17
|
170.1 |
|
18
|
8.12 |
6
|
36.5 |
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Show spectrum in full size
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H,H-NOESY Spectrum | 60000197
Rating: 10 |
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| Type | H,H-NOESY |
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Measurement conditions
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| Temperature [K] | 298 |
| Solvent | Chloroform-D1 (CDCl3) |
| Field Strength [MHz] | 125.0 |
| Literature |
Johannes Appun; Hans-Ullrich Siehl; Klaus-Peter Zeller; Katrin Steinke; Stefan Berger; Dieter Sicker: Colchicin, in: Chemie in unserer Zeit, vol. 48/2014, pp. 36 - 44 (DOI: 10.1002/ciuz.201400653)
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| Additional comments | |
| Additional information |
|
| Spectrum categories | ChiuZ |
Report incorrect data
Copy dataset link
DOI for this dataset: 10.18716/nmrshiftdb2/60000009/chiuz_cdcl3
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