CID 79307949

Tert-butyl 3-carbamoyl-3-(piperazin-1-yl)azetidine-1-carboxylate

Structural Information

Molecular Formula
C13H24N4O3
SMILES
CC(C)(C)OC(=O)N1CC(C1)(C(=O)N)N2CCNCC2
InChI
InChI=1S/C13H24N4O3/c1-12(2,3)20-11(19)16-8-13(9-16,10(14)18)17-6-4-15-5-7-17/h15H,4-9H2,1-3H3,(H2,14,18)
InChIKey
SWPMSKBCNHQVCT-UHFFFAOYSA-N
Compound name
tert-butyl 3-carbamoyl-3-piperazin-1-ylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.18484 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.19212 173.0
[M+Na]+ 307.17406 174.4
[M+NH4]+ 302.21866 174.1
[M+K]+ 323.14800 172.5
[M-H]- 283.17756 168.4
[M+Na-2H]- 305.15951 172.6
[M]+ 284.18429 170.2
[M]- 284.18539 170.2
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.