CID 53484509

1955547-69-9

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)N1CC(C1)NC2CCC2
InChI
InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-7-10(8-14)13-9-5-4-6-9/h9-10,13H,4-8H2,1-3H3
InChIKey
WEJZFJAOSPRHNC-UHFFFAOYSA-N
Compound name
tert-butyl 3-(cyclobutylamino)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.16812 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.175396 151.0
[M+Na]+ 249.157338 152.2
[M-H]- 225.160844 154.9
[M+NH4]+ 244.201943 154.3
[M+K]+ 265.131278 157.7
[M+H-H2O]+ 209.165380 134.4
[M+HCOO]- 271.166321 166.0
[M+CH3COO]- 285.181971 203.4
[M+Na-2H]- 247.142786 152.9
[M]+ 226.16757142 165.6
[M]- 226.16866858 165.6
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.