CID 756

Glycolaldehyde

Structural Information

Molecular Formula
C2H4O2
SMILES
C(C=O)O
InChI
InChI=1S/C2H4O2/c3-1-2-4/h1,4H,2H2
InChIKey
WGCNASOHLSPBMP-UHFFFAOYSA-N
Compound name
2-hydroxyacetaldehyde
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

508
References

203688
Patents

60.02113 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 61.028406 105.3
[M+Na]+ 83.010348 114.1
[M-H]- 59.013854 104.9
[M+NH4]+ 78.054953 129.6
[M+K]+ 98.984288 114.4
[M+H-H2O]+ 43.018390 102.0
[M+HCOO]- 105.01933 129.6
[M+CH3COO]- 119.03498 155.3
[M+Na-2H]- 80.995796 114.2
[M]+ 60.020581 105.4
[M]- 60.021679 105.4
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