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]+ 217.11829 150.9
[M+Na]+ 239.10023 155.0
[M-H]- 215.10373 152.4
[M+NH4]+ 234.14483 161.1
[M+K]+ 255.07417 159.0
[M+H-H2O]+ 199.10827 139.1
[M+HCOO]- 261.10921 168.6
[M+CH3COO]- 275.12486 191.1
[M+Na-2H]- 237.08568 152.6
[M]+ 216.11046 160.0
[M]- 216.11156 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.