CID 64208

25517-06-0

Structural Information

Molecular Formula
C17H28N2O
SMILES
C1CCN(CC1)CC(=O)NC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C17H28N2O/c20-16(12-19-4-2-1-3-5-19)18-17-9-13-6-14(10-17)8-15(7-13)11-17/h13-15H,1-12H2,(H,18,20)
InChIKey
MBHYKLRLZSHMMQ-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

8
Patents

276.22015 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.22743 162.3
[M+Na]+ 299.20937 159.8
[M-H]- 275.21287 157.2
[M+NH4]+ 294.25397 182.6
[M+K]+ 315.18331 156.1
[M+H-H2O]+ 259.21741 153.0
[M+HCOO]- 321.21835 164.2
[M+CH3COO]- 335.23400 167.6
[M+Na-2H]- 297.19482 169.9
[M]+ 276.21960 156.3
[M]- 276.22070 156.3
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

patents stripe