CID 163086

65463-19-6

Structural Information

Molecular Formula
C10H14NO5P
SMILES
COC(=O)CNCP(=O)(O)OC1=CC=CC=C1
InChI
InChI=1S/C10H14NO5P/c1-15-10(12)7-11-8-17(13,14)16-9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3,(H,13,14)
InChIKey
LFKRSEWYGNQQNF-UHFFFAOYSA-N
Compound name
[(2-methoxy-2-oxoethyl)amino]methyl-phenoxyphosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.06097 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.06825 156.5
[M+Na]+ 282.05019 161.8
[M-H]- 258.05369 157.3
[M+NH4]+ 277.09479 172.4
[M+K]+ 298.02413 161.1
[M+H-H2O]+ 242.05823 147.7
[M+HCOO]- 304.05917 184.2
[M+CH3COO]- 318.07482 192.8
[M+Na-2H]- 280.03564 160.0
[M]+ 259.06042 159.9
[M]- 259.06152 159.9
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.