CID 69409413

Tert-butyl 3-(2-aminoethoxy)azetidine-1-carboxylate

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)N1CC(C1)OCCN
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-6-8(7-12)14-5-4-11/h8H,4-7,11H2,1-3H3
InChIKey
IGZIPLMOZHQEPQ-UHFFFAOYSA-N
Compound name
tert-butyl 3-(2-aminoethoxy)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

216.1474 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.154676 153.3
[M+Na]+ 239.136618 157.2
[M-H]- 215.140124 154.5
[M+NH4]+ 234.181223 163.7
[M+K]+ 255.110558 160.4
[M+H-H2O]+ 199.144660 141.4
[M+HCOO]- 261.145601 171.3
[M+CH3COO]- 275.161251 192.6
[M+Na-2H]- 237.122066 155.6
[M]+ 216.14685142 162.8
[M]- 216.14794858 162.8
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