CID 3059282

Exo-2-methoxy-n-(8-benzyl-8-azabicyclo(3.2.1)oct-3-yl)benzamide hydrochloride

Structural Information

Molecular Formula
C22H26N2O2
SMILES
COC1=CC=CC=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4
InChI
InChI=1S/C22H26N2O2/c1-26-21-10-6-5-9-20(21)22(25)23-17-13-18-11-12-19(14-17)24(18)15-16-7-3-2-4-8-16/h2-10,17-19H,11-15H2,1H3,(H,23,25)
InChIKey
FDLCAYMOZUDADK-UHFFFAOYSA-N
Compound name
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

350.19943 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.206706 184.4
[M+Na]+ 373.188648 187.8
[M-H]- 349.192154 191.0
[M+NH4]+ 368.233253 198.4
[M+K]+ 389.162588 182.6
[M+H-H2O]+ 333.196690 174.8
[M+HCOO]- 395.197631 201.2
[M+CH3COO]- 409.213281 193.1
[M+Na-2H]- 371.174096 185.1
[M]+ 350.19888142 181.7
[M]- 350.19997858 181.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.