CID 83904853

Lithium(1+) ion 2-hydroxy-2-(oxetan-3-yl)acetate

Structural Information

Molecular Formula
C5H8O4
SMILES
C1C(CO1)C(C(=O)O)O
InChI
InChI=1S/C5H8O4/c6-4(5(7)8)3-1-9-2-3/h3-4,6H,1-2H2,(H,7,8)
InChIKey
HKZBOASSRSBTEY-UHFFFAOYSA-N
Compound name
2-hydroxy-2-(oxetan-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

132.04225 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.04953 126.8
[M+Na]+ 155.03147 130.8
[M+NH4]+ 150.07607 129.3
[M+K]+ 171.00541 130.8
[M-H]- 131.03497 123.7
[M+Na-2H]- 153.01692 126.4
[M]+ 132.04170 124.9
[M]- 132.04280 124.9
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

No patent data available for this compound.