CID 84080245

Tert-butyl 3-(1-amino-2-methylpropan-2-yl)azetidine-1-carboxylate

Structural Information

Molecular Formula
C12H24N2O2
SMILES
CC(C)(C)OC(=O)N1CC(C1)C(C)(C)CN
InChI
InChI=1S/C12H24N2O2/c1-11(2,3)16-10(15)14-6-9(7-14)12(4,5)8-13/h9H,6-8,13H2,1-5H3
InChIKey
YIGSVYJNDHDLNU-UHFFFAOYSA-N
Compound name
tert-butyl 3-(1-amino-2-methylpropan-2-yl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.18378 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.19106 160.4
[M+Na]+ 251.17300 164.1
[M-H]- 227.17650 161.7
[M+NH4]+ 246.21760 170.6
[M+K]+ 267.14694 166.7
[M+H-H2O]+ 211.18104 149.2
[M+HCOO]- 273.18198 176.0
[M+CH3COO]- 287.19763 196.9
[M+Na-2H]- 249.15845 162.4
[M]+ 228.18323 168.7
[M]- 228.18433 168.7
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.