CID 375080

Nsc654034

Structural Information

Molecular Formula
C17H30N2
SMILES
CN1CCCC(C1)CNC2C3CC4CC(C3)CC2C4
InChI
InChI=1S/C17H30N2/c1-19-4-2-3-12(11-19)10-18-17-15-6-13-5-14(8-15)9-16(17)7-13/h12-18H,2-11H2,1H3
InChIKey
MUUPYBQXXHGUNL-UHFFFAOYSA-N
Compound name
N-[(1-methylpiperidin-3-yl)methyl]adamantan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.2409 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.24818 160.6
[M+Na]+ 285.23012 158.7
[M-H]- 261.23362 156.0
[M+NH4]+ 280.27472 180.2
[M+K]+ 301.20406 154.6
[M+H-H2O]+ 245.23816 151.9
[M+HCOO]- 307.23910 163.2
[M+CH3COO]- 321.25475 166.3
[M+Na-2H]- 283.21557 166.9
[M]+ 262.24035 154.9
[M]- 262.24145 154.9
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.