CID 2779466

4-ethoxyphenylphosphonic acid

Structural Information

Molecular Formula
C8H11O4P
SMILES
CCOC1=CC=C(C=C1)P(=O)(O)O
InChI
InChI=1S/C8H11O4P/c1-2-12-7-3-5-8(6-4-7)13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11)
InChIKey
ORUZLAKPEKBACC-UHFFFAOYSA-N
Compound name
(4-ethoxyphenyl)phosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

202.03949 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.04677 143.1
[M+Na]+ 225.02871 150.8
[M-H]- 201.03221 143.2
[M+NH4]+ 220.07331 161.5
[M+K]+ 241.00265 149.2
[M+H-H2O]+ 185.03675 135.8
[M+HCOO]- 247.03769 169.5
[M+CH3COO]- 261.05334 178.9
[M+Na-2H]- 223.01416 147.1
[M]+ 202.03894 145.2
[M]- 202.04004 145.2
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.