CID 2723641

2,2-dihydroxyacetic acid

Structural Information

Molecular Formula
C2H4O4
SMILES
C(C(=O)O)(O)O
InChI
InChI=1S/C2H4O4/c3-1(4)2(5)6/h1,3-4H,(H,5,6)
InChIKey
GOCCREQJUBABAL-UHFFFAOYSA-N
Compound name
2,2-dihydroxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

1150
Patents

92.010956 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 93.018232 113.8
[M+Na]+ 115.00017 121.9
[M+NH4]+ 110.04478 119.8
[M+K]+ 130.97411 120.5
[M-H]- 91.003680 110.1
[M+Na-2H]- 112.98562 115.3
[M]+ 92.010407 113.3
[M]- 92.011505 113.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe