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]+ 351.20671 184.4
[M+Na]+ 373.18865 187.8
[M-H]- 349.19215 191.0
[M+NH4]+ 368.23325 198.4
[M+K]+ 389.16259 182.6
[M+H-H2O]+ 333.19669 174.8
[M+HCOO]- 395.19763 201.2
[M+CH3COO]- 409.21328 193.1
[M+Na-2H]- 371.17410 185.1
[M]+ 350.19888 181.7
[M]- 350.19998 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.