CID 16244613

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

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CC(C)(C)OC(=O)N1CCC1CN
InChI
InChI=1S/C9H18N2O2/c1-9(2,3)13-8(12)11-5-4-7(11)6-10/h7H,4-6,10H2,1-3H3
InChIKey
XTIGSUFOTRCYOO-UHFFFAOYSA-N
Compound name
tert-butyl 2-(aminomethyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

186.13683 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.14411 147.0
[M+Na]+ 209.12605 150.6
[M+NH4]+ 204.17065 149.2
[M+K]+ 225.09999 149.1
[M-H]- 185.12955 143.4
[M+Na-2H]- 207.11150 146.8
[M]+ 186.13628 144.9
[M]- 186.13738 144.9
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