CID 64420

Picolinamide, n-(1-adamantyl)-

Structural Information

Molecular Formula
C16H20N2O
SMILES
C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC=CC=N4
InChI
InChI=1S/C16H20N2O/c19-15(14-3-1-2-4-17-14)18-16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13H,5-10H2,(H,18,19)
InChIKey
KDPXTORXIBWFOA-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

256.15756 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 155.3
[M+Na]+ 279.14678 156.3
[M-H]- 255.15028 152.0
[M+NH4]+ 274.19138 176.8
[M+K]+ 295.12072 152.4
[M+H-H2O]+ 239.15482 146.2
[M+HCOO]- 301.15576 162.1
[M+CH3COO]- 315.17141 162.8
[M+Na-2H]- 277.13223 166.6
[M]+ 256.15701 153.4
[M]- 256.15811 153.4
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