CID 156292820

2636798-45-1

Structural Information

Molecular Formula
C16H31N3O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)N(C)C2CCNCC2
InChI
InChI=1S/C16H31N3O2/c1-16(2,3)21-15(20)19-11-7-14(8-12-19)18(4)13-5-9-17-10-6-13/h13-14,17H,5-12H2,1-4H3
InChIKey
VLMHCQBSYFJRLR-UHFFFAOYSA-N
Compound name
tert-butyl 4-[methyl(piperidin-4-yl)amino]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

297.24164 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.24892 175.8
[M+Na]+ 320.23086 175.7
[M-H]- 296.23436 177.4
[M+NH4]+ 315.27546 187.4
[M+K]+ 336.20480 174.4
[M+H-H2O]+ 280.23890 166.8
[M+HCOO]- 342.23984 186.2
[M+CH3COO]- 356.25549 205.1
[M+Na-2H]- 318.21631 175.2
[M]+ 297.24109 168.0
[M]- 297.24219 168.0
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

patents stripe