CID 105820

67846-69-9

Structural Information

Molecular Formula
C3H9O5P
SMILES
COP(=O)(O)OCCO
InChI
InChI=1S/C3H9O5P/c1-7-9(5,6)8-3-2-4/h4H,2-3H2,1H3,(H,5,6)
InChIKey
WHRQRNQSZWMIMU-UHFFFAOYSA-N
Compound name
2-hydroxyethyl methyl hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

27
Patents

156.01875 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.02603 130.9
[M+Na]+ 179.00797 138.5
[M-H]- 155.01147 127.6
[M+NH4]+ 174.05257 151.0
[M+K]+ 194.98191 139.1
[M+H-H2O]+ 139.01601 124.8
[M+HCOO]- 201.01695 157.5
[M+CH3COO]- 215.03260 169.3
[M+Na-2H]- 176.99342 135.8
[M]+ 156.01820 134.9
[M]- 156.01930 134.9
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

No patent data available for this compound.