CID 54527850

1-(3-aminoazetidin-1-yl)ethanone

Structural Information

Molecular Formula
C5H10N2O
SMILES
CC(=O)N1CC(C1)N
InChI
InChI=1S/C5H10N2O/c1-4(8)7-2-5(6)3-7/h5H,2-3,6H2,1H3
InChIKey
YUJHTWYBKVAQEN-UHFFFAOYSA-N
Compound name
1-(3-aminoazetidin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

131
Patents

114.079315 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.08659 125.1
[M+Na]+ 137.06853 130.2
[M+NH4]+ 132.11314 128.8
[M+K]+ 153.04247 128.0
[M-H]- 113.07204 122.8
[M+Na-2H]- 135.05398 126.6
[M]+ 114.07877 123.6
[M]- 114.07986 123.6
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

patents stripe