COMPOUND: C22781
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Entry
C22781 Compound
Name
(1-Pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone;
UR-144;
(1-Pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropan-1-yl)methanone
Formula
C21H29NO
Exact mass
311.2249
Mol weight
311.46
Structure
Mol file
KCF file
DB search
Brite
Narcotics and psychotropics in Japan [
br08308.html
]
Narcotics by Cabinet Order Article 1 (163 substances)
C22781
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Other DBs
CAS:
1199943-44-6
PubChem:
497620136
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KCF data
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ATOM 23
1 C8x C 13.9508 -14.9322
2 C8x C 13.9508 -16.3343
3 C8x C 15.0724 -17.0354
4 C8y C 16.3343 -16.3343
5 C8y C 16.3343 -14.9322
6 C8x C 15.0724 -14.2312
7 N4y N 17.6663 -16.7549
8 C8x C 18.5075 -15.6333
9 C8y C 17.6663 -14.5116
10 C5a C 18.0869 -13.2497
11 C1b C 18.2271 -18.0869
12 C1b C 20.1901 -19.4189
13 C1b C 19.6292 -18.2271
14 C1a C 22.0128 -20.8911
15 C1b C 21.5220 -19.6292
16 O5a O 17.1055 -12.2683
17 C1y C 19.5591 -13.1095
18 C1z C 20.5406 -12.1281
19 C1z C 20.7509 -13.8106
20 C1a C 19.8395 -10.9363
21 C1a C 20.1199 -15.0023
22 C1a C 21.8726 -11.7775
23 C1a C 22.1530 -13.8106
BOND 25
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 7 8 1
9 8 9 2
10 5 9 1
11 9 10 1
12 7 11 1
13 12 13 1
14 11 13 1
15 14 15 1
16 12 15 1
17 10 16 2
18 17 10 1
19 17 18 1
20 17 19 1
21 18 19 1
22 18 20 1
23 19 21 1
24 18 22 1
25 19 23 1
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