CID 82667702

1782015-60-4

Structural Information

Molecular Formula
C17H32N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)CCC2CCNCC2
InChI
InChI=1S/C17H32N2O2/c1-17(2,3)21-16(20)19-12-4-5-15(13-19)7-6-14-8-10-18-11-9-14/h14-15,18H,4-13H2,1-3H3
InChIKey
LVOYGOJUPJUXBQ-UHFFFAOYSA-N
Compound name
tert-butyl 3-(2-piperidin-4-ylethyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.24637 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.253646 178.1
[M+Na]+ 319.235588 178.2
[M-H]- 295.239094 178.0
[M+NH4]+ 314.280193 189.4
[M+K]+ 335.209528 175.3
[M+H-H2O]+ 279.243630 169.3
[M+HCOO]- 341.244571 186.6
[M+CH3COO]- 355.260221 199.7
[M+Na-2H]- 317.221036 177.0
[M]+ 296.24582142 170.0
[M]- 296.24691858 170.0
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.