CID 44607604

P-dihydroxyethoxyacetate

Structural Information

Molecular Formula
C4H8O5
SMILES
C(C(O)OCC(=O)O)O
InChI
InChI=1S/C4H8O5/c5-1-4(8)9-2-3(6)7/h4-5,8H,1-2H2,(H,6,7)
InChIKey
ZQBWCQHCMJERPW-UHFFFAOYSA-N
Compound name
2-(1,2-dihydroxyethoxy)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

136.03717 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.04445 125.3
[M+Na]+ 159.02639 132.6
[M+NH4]+ 154.07099 130.5
[M+K]+ 175.00033 131.2
[M-H]- 135.02989 121.0
[M+Na-2H]- 157.01184 125.9
[M]+ 136.03662 124.5
[M]- 136.03772 124.5
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.