CID 165720644

En300-1643781

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)N1CC(C1)(C(C)(C)N)O
InChI
InChI=1S/C11H22N2O3/c1-9(2,3)16-8(14)13-6-11(15,7-13)10(4,5)12/h15H,6-7,12H2,1-5H3
InChIKey
XDQJMLZZDDVCMT-UHFFFAOYSA-N
Compound name
tert-butyl 3-(2-aminopropan-2-yl)-3-hydroxyazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.16304 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.17032 160.1
[M+Na]+ 253.15226 164.3
[M-H]- 229.15576 160.5
[M+NH4]+ 248.19686 171.3
[M+K]+ 269.12620 167.2
[M+H-H2O]+ 213.16030 150.7
[M+HCOO]- 275.16124 174.7
[M+CH3COO]- 289.17689 193.1
[M+Na-2H]- 251.13771 163.5
[M]+ 230.16249 168.0
[M]- 230.16359 168.0
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.