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]+ 143.010386 128.8
[M+Na]+ 164.992328 135.6
[M-H]- 140.995834 122.8
[M+NH4]+ 160.036933 147.8
[M+K]+ 180.966268 135.1
[M+H-H2O]+ 125.000370 123.2
[M+HCOO]- 187.001311 151.6
[M+CH3COO]- 201.016961 162.2
[M+Na-2H]- 162.977776 131.7
[M]+ 142.00256142 127.7
[M]- 142.00365858 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