CID 3052196

F 1533

Structural Information

Molecular Formula
C19H29N3O
SMILES
C1CCN(CC1)C(C2=CC=CC=C2)C(=O)NCCN3CCCC3
InChI
InChI=1S/C19H29N3O/c23-19(20-11-16-21-12-7-8-13-21)18(17-9-3-1-4-10-17)22-14-5-2-6-15-22/h1,3-4,9-10,18H,2,5-8,11-16H2,(H,20,23)
InChIKey
DGTNZWVKKHSDGI-UHFFFAOYSA-N
Compound name
2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

315.23105 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.238326 178.3
[M+Na]+ 338.220268 177.4
[M-H]- 314.223774 182.6
[M+NH4]+ 333.264873 189.8
[M+K]+ 354.194208 173.5
[M+H-H2O]+ 298.228310 167.3
[M+HCOO]- 360.229251 192.6
[M+CH3COO]- 374.244901 206.9
[M+Na-2H]- 336.205716 176.6
[M]+ 315.23050142 169.7
[M]- 315.23159858 169.7
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

patents stripe