CID 3045971

61341-15-9

Structural Information

Molecular Formula
C4H10NO5P
SMILES
COC(=O)CC(N)P(=O)(O)O
InChI
InChI=1S/C4H10NO5P/c1-10-4(6)2-3(5)11(7,8)9/h3H,2,5H2,1H3,(H2,7,8,9)
InChIKey
CAVPCAWZXLCJGO-UHFFFAOYSA-N
Compound name
(1-amino-3-methoxy-3-oxopropyl)phosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.02966 Da
Monoisotopic Mass

-4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.036936 138.1
[M+Na]+ 206.018878 144.2
[M-H]- 182.022384 134.3
[M+NH4]+ 201.063483 156.4
[M+K]+ 221.992818 144.7
[M+H-H2O]+ 166.026920 131.5
[M+HCOO]- 228.027861 163.0
[M+CH3COO]- 242.043511 177.0
[M+Na-2H]- 204.004326 139.2
[M]+ 183.02911142 138.4
[M]- 183.03020858 138.4
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.