CID 50986502

Tert-butyl n-[4-(4-aminopiperidin-1-yl)-4-oxobutyl]carbamate

Structural Information

Molecular Formula
C14H27N3O3
SMILES
CC(C)(C)OC(=O)NCCCC(=O)N1CCC(CC1)N
InChI
InChI=1S/C14H27N3O3/c1-14(2,3)20-13(19)16-8-4-5-12(18)17-9-6-11(15)7-10-17/h11H,4-10,15H2,1-3H3,(H,16,19)
InChIKey
LVZKPMUNZXCKKX-UHFFFAOYSA-N
Compound name
tert-butyl N-[4-(4-aminopiperidin-1-yl)-4-oxobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.20523 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.21251 171.0
[M+Na]+ 308.19445 173.0
[M-H]- 284.19795 171.3
[M+NH4]+ 303.23905 184.5
[M+K]+ 324.16839 172.0
[M+H-H2O]+ 268.20249 163.6
[M+HCOO]- 330.20343 187.2
[M+CH3COO]- 344.21908 204.6
[M+Na-2H]- 306.17990 171.2
[M]+ 285.20468 167.6
[M]- 285.20578 167.6
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.