CID 80351575

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

Structural Information

Molecular Formula
C12H22N2O3
SMILES
CC(C)(C)OC(=O)N1CC(C1)NC2CCOC2
InChI
InChI=1S/C12H22N2O3/c1-12(2,3)17-11(15)14-6-10(7-14)13-9-4-5-16-8-9/h9-10,13H,4-8H2,1-3H3
InChIKey
KLXMWUVMJOWEFL-UHFFFAOYSA-N
Compound name
tert-butyl 3-(oxolan-3-ylamino)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.16304 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.17032 154.5
[M+Na]+ 265.15226 156.6
[M-H]- 241.15576 159.4
[M+NH4]+ 260.19686 164.1
[M+K]+ 281.12620 160.5
[M+H-H2O]+ 225.16030 142.6
[M+HCOO]- 287.16124 171.1
[M+CH3COO]- 301.17689 195.5
[M+Na-2H]- 263.13771 156.7
[M]+ 242.16249 161.9
[M]- 242.16359 161.9
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.