CID 69099328

Tert-butyl 2-(2-aminoethyl)azetidine-1-carboxylate

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC(C)(C)OC(=O)N1CCC1CCN
InChI
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-5-8(12)4-6-11/h8H,4-7,11H2,1-3H3
InChIKey
KHJAQTONQACTCR-UHFFFAOYSA-N
Compound name
tert-butyl 2-(2-aminoethyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

200.15248 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.159756 151.1
[M+Na]+ 223.141698 155.3
[M-H]- 199.145204 152.4
[M+NH4]+ 218.186303 162.3
[M+K]+ 239.115638 157.9
[M+H-H2O]+ 183.149740 139.5
[M+HCOO]- 245.150681 168.9
[M+CH3COO]- 259.166331 190.6
[M+Na-2H]- 221.127146 153.3
[M]+ 200.15193142 159.3
[M]- 200.15302858 159.3
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