COMPOUND: C22695
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Entry
C22695 Compound
Name
N-(1-Adamantyl)-1-(5-fluoropentyl)-1H-indazole-3-carboxamide;
N-(Adamantan-1-yl)-1-(5-fluoropentyl)-1H-indazole-3-carboxamide;
APINACA N-(5-fluoropentyl);
5F-APINACA
Formula
C23H30FN3O
Exact mass
383.2373
Mol weight
383.5022
Structure
Mol file
KCF file
DB search
Brite
Narcotics and psychotropics in Japan [
br08308.html
]
Narcotics by Cabinet Order Article 1 (157 substances)
C22695
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Other DBs
CAS:
1400742-13-3
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KCF data
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ATOM 28
1 C8x C 14.2100 -34.8600
2 C8x C 14.2100 -36.2600
3 C8x C 15.3300 -36.9600
4 C8y C 16.5900 -36.2600
5 C8y C 16.5900 -34.8600
6 C8x C 15.3300 -34.1600
7 N4y N 17.9200 -36.6800
8 N5x N 18.8300 -35.5600
9 C8y C 17.9200 -34.4400
10 C1b C 18.4800 -38.0100
11 C5a C 18.4800 -33.2500
12 O5a O 17.6400 -32.1300
13 C1b C 20.5100 -39.4100
14 C1b C 19.9500 -38.1500
15 C1b C 22.4000 -40.8100
16 C1b C 21.8400 -39.5500
17 X F 23.7300 -40.9500
18 N1b N 19.7400 -32.9700
19 C1z C 20.2300 -31.7800
20 C1x C 21.4200 -31.5700
21 C1y C 21.7700 -30.3100
22 C1x C 21.0700 -29.4000
23 C1y C 19.8100 -29.6800
24 C1x C 19.3900 -30.8000
25 C1x C 21.1400 -30.9400
26 C1y C 21.7700 -29.1900
27 C1x C 23.2400 -29.7500
28 C1x C 21.0000 -28.0700
BOND 32
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 8 9 2
9 5 9 1
10 7 10 1
11 9 11 1
12 11 12 2
13 7 8 1
14 13 14 1
15 10 14 1
16 15 16 1
17 13 16 1
18 15 17 1
19 11 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 19 24 1
27 19 25 1
28 25 26 1
29 26 27 1
30 26 28 1
31 23 28 1
32 21 27 1
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