CID 65993758

2377031-34-8

Structural Information

Molecular Formula

C₅H₁₁N₃O

SMILES

C1C(CN1C(=O)N)CN

InChI

InChI=1S/C5H11N3O/c6-1-4-2-8(3-4)5(7)9/h4H,1-3,6H2,(H2,7,9)

InChIKey

CTPMHNRIGIGCPF-UHFFFAOYSA-N

Compound name

3-(aminomethyl)azetidine-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 129.09021 Da
Monoisotopic Mass: -1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	130.09749	131.3
[M+Na]+	152.07943	134.8
[M+NH4]+	147.12403	134.2
[M+K]+	168.05337	133.1
[M-H]-	128.08293	129.0
[M+Na-2H]-	150.06488	131.7
[M]+	129.08966	129.4
[M]-	129.09076	129.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.