CID 80120927

Tert-butyl 3-[(oxetan-3-yl)amino]azetidine-1-carboxylate

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)N1CC(C1)NC2COC2
InChI
InChI=1S/C11H20N2O3/c1-11(2,3)16-10(14)13-4-8(5-13)12-9-6-15-7-9/h8-9,12H,4-7H2,1-3H3
InChIKey
AGXKOYRLTABGHX-UHFFFAOYSA-N
Compound name
tert-butyl 3-(oxetan-3-ylamino)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1474 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.154676 146.2
[M+Na]+ 251.136618 147.5
[M-H]- 227.140124 150.9
[M+NH4]+ 246.181223 148.2
[M+K]+ 267.110558 154.7
[M+H-H2O]+ 211.144660 129.6
[M+HCOO]- 273.145601 161.0
[M+CH3COO]- 287.161251 202.6
[M+Na-2H]- 249.122066 149.7
[M]+ 228.14685142 162.3
[M]- 228.14794858 162.3
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.