CID 71279891

Tert-butyl 3-(1-aminoethyl)azetidine-1-carboxylate

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC(C1CN(C1)C(=O)OC(C)(C)C)N
InChI
InChI=1S/C10H20N2O2/c1-7(11)8-5-12(6-8)9(13)14-10(2,3)4/h7-8H,5-6,11H2,1-4H3
InChIKey
JSURSCDQTBSUPP-UHFFFAOYSA-N
Compound name
tert-butyl 3-(1-aminoethyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

200.15248 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 152.3
[M+Na]+ 223.14170 155.4
[M+NH4]+ 218.18630 154.3
[M+K]+ 239.11564 154.4
[M-H]- 199.14520 148.5
[M+Na-2H]- 221.12715 151.5
[M]+ 200.15193 150.1
[M]- 200.15303 150.1
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

patents stripe