CID 155943764

2613386-46-0

Structural Information

Molecular Formula
C17H32N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC(CCC1)C2CCNCC2
InChI
InChI=1S/C17H32N2O2/c1-17(2,3)21-16(20)19-12-4-6-14(7-5-13-19)15-8-10-18-11-9-15/h14-15,18H,4-13H2,1-3H3
InChIKey
GTFZMDCGXOJFFP-UHFFFAOYSA-N
Compound name
tert-butyl 5-piperidin-4-ylazocane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.24637 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.25365 160.9
[M+Na]+ 319.23559 163.3
[M+NH4]+ 314.28019 162.9
[M+K]+ 335.20953 162.7
[M-H]- 295.23909 161.1
[M+Na-2H]- 317.22104 162.6
[M]+ 296.24582 161.1
[M]- 296.24692 161.1
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.