CID 72207613

1-boc-3-(aminomethyl)-3-ethylazetidine

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CCC1(CN(C1)C(=O)OC(C)(C)C)CN
InChI
InChI=1S/C11H22N2O2/c1-5-11(6-12)7-13(8-11)9(14)15-10(2,3)4/h5-8,12H2,1-4H3
InChIKey
UMIOUCAYFXZLSB-UHFFFAOYSA-N
Compound name
tert-butyl 3-(aminomethyl)-3-ethylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.16812 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.17540 155.5
[M+Na]+ 237.15734 158.9
[M+NH4]+ 232.20194 158.9
[M+K]+ 253.13128 155.3
[M-H]- 213.16084 151.9
[M+Na-2H]- 235.14279 156.4
[M]+ 214.16757 153.6
[M]- 214.16867 153.6
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.