CID 64232

1-pyrrolidinepropionamide, n-1-adamantyl-, monohydrochloride

Structural Information

Molecular Formula
C17H28N2O
SMILES
C1CCN(C1)CCC(=O)NC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C17H28N2O/c20-16(3-6-19-4-1-2-5-19)18-17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,1-12H2,(H,18,20)
InChIKey
ZMZXGZLCMMJVPT-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)-3-pyrrolidin-1-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.22015 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.22743 162.8
[M+Na]+ 299.20937 161.4
[M-H]- 275.21287 158.3
[M+NH4]+ 294.25397 185.2
[M+K]+ 315.18331 157.3
[M+H-H2O]+ 259.21741 154.7
[M+HCOO]- 321.21835 167.1
[M+CH3COO]- 335.23400 169.0
[M+Na-2H]- 297.19482 168.5
[M]+ 276.21960 159.1
[M]- 276.22070 159.1
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.