CID 165881976

Tert-butyl 2-cyclobutyl-3-oxoazetidine-1-carboxylate

Structural Information

Molecular Formula
C12H19NO3
SMILES
CC(C)(C)OC(=O)N1CC(=O)C1C2CCC2
InChI
InChI=1S/C12H19NO3/c1-12(2,3)16-11(15)13-7-9(14)10(13)8-5-4-6-8/h8,10H,4-7H2,1-3H3
InChIKey
YVTUFTRHFGVYID-UHFFFAOYSA-N
Compound name
tert-butyl 2-cyclobutyl-3-oxoazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.13649 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.14377 145.2
[M+Na]+ 248.12571 148.5
[M-H]- 224.12921 149.8
[M+NH4]+ 243.17031 149.2
[M+K]+ 264.09965 153.8
[M+H-H2O]+ 208.13375 130.1
[M+HCOO]- 270.13469 159.9
[M+CH3COO]- 284.15034 201.2
[M+Na-2H]- 246.11116 146.8
[M]+ 225.13594 161.7
[M]- 225.13704 161.7
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.