CID 374452

Nsc652164

Structural Information

Molecular Formula
C17H30N2
SMILES
CN1CCCC(C1)CNC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C17H30N2/c1-19-4-2-3-13(12-19)11-18-17-8-14-5-15(9-17)7-16(6-14)10-17/h13-16,18H,2-12H2,1H3
InChIKey
GKLPJMXGOMUSEO-UHFFFAOYSA-N
Compound name
N-[(1-methylpiperidin-3-yl)methyl]adamantan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.2409 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.24818 161.2
[M+Na]+ 285.23012 159.8
[M-H]- 261.23362 156.6
[M+NH4]+ 280.27472 182.6
[M+K]+ 301.20406 155.4
[M+H-H2O]+ 245.23816 151.7
[M+HCOO]- 307.23910 163.8
[M+CH3COO]- 321.25475 167.0
[M+Na-2H]- 283.21557 168.8
[M]+ 262.24035 155.4
[M]- 262.24145 155.4
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.