CID 84050300

2-[(1-acetylazetidin-3-yl)oxy]acetic acid

Structural Information

Molecular Formula
C7H11NO4
SMILES
CC(=O)N1CC(C1)OCC(=O)O
InChI
InChI=1S/C7H11NO4/c1-5(9)8-2-6(3-8)12-4-7(10)11/h6H,2-4H2,1H3,(H,10,11)
InChIKey
CDSKFICLVMNVMI-UHFFFAOYSA-N
Compound name
2-(1-acetylazetidin-3-yl)oxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.0688 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.07608 139.1
[M+Na]+ 196.05802 143.1
[M+NH4]+ 191.10262 140.6
[M+K]+ 212.03196 142.3
[M-H]- 172.06152 134.2
[M+Na-2H]- 194.04347 138.3
[M]+ 173.06825 136.5
[M]- 173.06935 136.5
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.