CID 212621

24606-57-3

Structural Information

Molecular Formula
C19H29N3O
SMILES
CCC(=O)N(C1=CC=CC=N1)C(C)CN2CC3CCC(C2)CC3
InChI
InChI=1S/C19H29N3O/c1-3-19(23)22(18-6-4-5-11-20-18)15(2)12-21-13-16-7-8-17(14-21)10-9-16/h4-6,11,15-17H,3,7-10,12-14H2,1-2H3
InChIKey
HSJZVJRGFXJXQZ-UHFFFAOYSA-N
Compound name
N-[1-(3-azabicyclo[3.2.2]nonan-3-yl)propan-2-yl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.23105 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.238326 179.5
[M+Na]+ 338.220268 184.7
[M-H]- 314.223774 181.5
[M+NH4]+ 333.264873 194.7
[M+K]+ 354.194208 182.4
[M+H-H2O]+ 298.228310 176.3
[M+HCOO]- 360.229251 188.1
[M+CH3COO]- 374.244901 186.6
[M+Na-2H]- 336.205716 185.5
[M]+ 315.23050142 178.5
[M]- 315.23159858 178.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.