COMPOUND: C22720
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Entry
C22720 Compound
Name
N-(2-Methoxybenzyl)-2-(4-chloro-2,5-dimethoxyphenyl)ethanamine;
2-(4-Chloro-2,5-dimethoxyphenyl)-N-(2-methoxybenzyl)ethanamine;
25C-NBOMe
Formula
C18H22ClNO3
Exact mass
335.1288
Mol weight
335.8252
Structure
Mol file
KCF file
DB search
Brite
Narcotics and psychotropics in Japan [
br08308.html
]
Narcotics by Cabinet Order Article 1 (157 substances)
C22720
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Other DBs
CAS:
1227608-02-7
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KCF data
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ATOM 23
1 C8y C 16.1328 -15.2891
2 C8y C 14.9405 -14.5878
3 C8x C 16.1328 -16.6917
4 C1b C 17.3952 -14.5878
5 C8x C 13.7482 -15.2891
6 C8y C 14.9405 -17.3931
7 C1b C 18.6574 -15.2891
8 C8y C 13.7482 -16.6917
9 O2a O 14.9405 -13.1851
10 X Cl 12.5559 -17.3931
11 O2a O 14.9405 -18.7957
12 C1b C 21.0859 -15.2491
13 N1b N 19.8601 -14.5681
14 C8y C 22.3002 -14.5478
15 C8y C 23.4972 -15.2386
16 C8x C 24.7113 -14.5369
17 C8x C 24.7108 -13.1348
18 C8x C 23.5140 -12.4443
19 C8x C 22.2998 -13.1457
20 O2a O 23.4972 -16.6407
21 C1a C 24.7115 -17.3420
22 C1a C 16.1529 -19.4957
23 C1a C 13.7280 -12.4851
BOND 24
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 2
6 4 7 1
7 5 8 2
8 6 8 1
9 2 9 1
10 8 10 1
11 6 11 1
12 12 13 1
13 7 13 1
14 12 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 14 19 1
21 15 20 1
22 20 21 1
23 11 22 1
24 9 23 1
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