CID 132353824

Tert-butyl 3-(carbamoyloxy)azetidine-1-carboxylate

Structural Information

Molecular Formula
C9H16N2O4
SMILES
CC(C)(C)OC(=O)N1CC(C1)OC(=O)N
InChI
InChI=1S/C9H16N2O4/c1-9(2,3)15-8(13)11-4-6(5-11)14-7(10)12/h6H,4-5H2,1-3H3,(H2,10,12)
InChIKey
FMABORXCTFSQHQ-UHFFFAOYSA-N
Compound name
tert-butyl 3-carbamoyloxyazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.11101 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.118286 150.9
[M+Na]+ 239.100228 155.0
[M-H]- 215.103734 152.4
[M+NH4]+ 234.144833 161.1
[M+K]+ 255.074168 159.0
[M+H-H2O]+ 199.108270 139.1
[M+HCOO]- 261.109211 168.6
[M+CH3COO]- 275.124861 191.1
[M+Na-2H]- 237.085676 152.6
[M]+ 216.11046142 160.0
[M]- 216.11155858 160.0
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

No patent data available for this compound.