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]+ 277.227426 162.8
[M+Na]+ 299.209368 161.4
[M-H]- 275.212874 158.3
[M+NH4]+ 294.253973 185.2
[M+K]+ 315.183308 157.3
[M+H-H2O]+ 259.217410 154.7
[M+HCOO]- 321.218351 167.1
[M+CH3COO]- 335.234001 169.0
[M+Na-2H]- 297.194816 168.5
[M]+ 276.21960142 159.1
[M]- 276.22069858 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.