CID 440756

[(1r)-2-amino-1-hydroxyethyl]phosphonic acid

Structural Information

Molecular Formula
C2H8NO4P
SMILES
C(C(O)P(=O)(O)O)N
InChI
InChI=1S/C2H8NO4P/c3-1-2(4)8(5,6)7/h2,4H,1,3H2,(H2,5,6,7)
InChIKey
RTTXIBKRJFIBBG-UHFFFAOYSA-N
Compound name
(2-amino-1-hydroxyethyl)phosphonic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

7788
Patents

141.01909 Da
Monoisotopic Mass

-5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.026366 129.3
[M+Na]+ 164.008308 135.7
[M-H]- 140.011814 124.2
[M+NH4]+ 159.052913 148.6
[M+K]+ 179.982248 135.3
[M+H-H2O]+ 124.016350 123.2
[M+HCOO]- 186.017291 153.7
[M+CH3COO]- 200.032941 167.0
[M+Na-2H]- 161.993756 131.7
[M]+ 141.01854142 126.8
[M]- 141.01963858 126.8
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