CID 89954

22987-21-9

Structural Information

Molecular Formula
C2H7O4P
SMILES
C(CP(=O)(O)O)O
InChI
InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)
InChIKey
SEHJHHHUIGULEI-UHFFFAOYSA-N
Compound name
2-hydroxyethylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

4
References

1074
Patents

126.008194 Da
Monoisotopic Mass

-2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.01547 125.4
[M+Na]+ 148.99741 133.1
[M-H]- 125.00092 120.9
[M+NH4]+ 144.04202 146.1
[M+K]+ 164.97135 132.5
[M+H-H2O]+ 109.00545 119.9
[M+HCOO]- 171.00640 150.6
[M+CH3COO]- 185.02204 161.6
[M+Na-2H]- 146.98286 130.0
[M]+ 126.00765 125.6
[M]- 126.00874 125.6
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