CID 84043227

1784369-48-7

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)N1CC(C1)OCCCN
InChI
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(14)13-7-9(8-13)15-6-4-5-12/h9H,4-8,12H2,1-3H3
InChIKey
CVXBORLLPDJFEM-UHFFFAOYSA-N
Compound name
tert-butyl 3-(3-aminopropoxy)azetidine-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 157.9
[M+Na]+ 253.15226 161.4
[M-H]- 229.15576 158.9
[M+NH4]+ 248.19686 167.7
[M+K]+ 269.12620 164.4
[M+H-H2O]+ 213.16030 145.8
[M+HCOO]- 275.16124 175.6
[M+CH3COO]- 289.17689 195.5
[M+Na-2H]- 251.13771 159.7
[M]+ 230.16249 167.8
[M]- 230.16359 167.8
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

No patent data available for this compound.