CID 14829591

1,2-dihydroxyethylphosphonate

Structural Information

Molecular Formula
C2H7O5P
SMILES
C(C(O)P(=O)(O)O)O
InChI
InChI=1S/C2H7O5P/c3-1-2(4)8(5,6)7/h2-4H,1H2,(H2,5,6,7)
InChIKey
JDBGBZHVBYODFB-UHFFFAOYSA-N
Compound name
1,2-dihydroxyethylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

16
Patents

142.00311 Da
Monoisotopic Mass

-2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.01039 128.8
[M+Na]+ 164.99233 135.6
[M-H]- 140.99583 122.8
[M+NH4]+ 160.03693 147.8
[M+K]+ 180.96627 135.1
[M+H-H2O]+ 125.00037 123.2
[M+HCOO]- 187.00131 151.6
[M+CH3COO]- 201.01696 162.2
[M+Na-2H]- 162.97778 131.7
[M]+ 142.00256 127.7
[M]- 142.00366 127.7
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

patents stripe