CID 169406

2-(phosphonooxy)ethyl acrylate

Structural Information

Molecular Formula
C5H9O6P
SMILES
C=CC(=O)OCCOP(=O)(O)O
InChI
InChI=1S/C5H9O6P/c1-2-5(6)10-3-4-11-12(7,8)9/h2H,1,3-4H2,(H2,7,8,9)
InChIKey
UDXXYUDJOHIIDZ-UHFFFAOYSA-N
Compound name
2-phosphonooxyethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

9500
Patents

196.01367 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.020946 139.0
[M+Na]+ 219.002888 146.1
[M-H]- 195.006394 135.5
[M+NH4]+ 214.047493 157.3
[M+K]+ 234.976828 146.0
[M+H-H2O]+ 179.010930 132.5
[M+HCOO]- 241.011871 164.6
[M+CH3COO]- 255.027521 175.8
[M+Na-2H]- 216.988336 142.1
[M]+ 196.01312142 143.1
[M]- 196.01421858 143.1
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