CID 85549

Hydroxy-peg3-acrylate

Structural Information

Molecular Formula
C9H16O5
SMILES
C=CC(=O)OCCOCCOCCO
InChI
InChI=1S/C9H16O5/c1-2-9(11)14-8-7-13-6-5-12-4-3-10/h2,10H,1,3-8H2
InChIKey
VETIYACESIPJSO-UHFFFAOYSA-N
Compound name
2-[2-(2-hydroxyethoxy)ethoxy]ethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3657
Patents

204.09978 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.107056 144.7
[M+Na]+ 227.088998 150.5
[M-H]- 203.092504 143.0
[M+NH4]+ 222.133603 163.0
[M+K]+ 243.062938 150.2
[M+H-H2O]+ 187.097040 139.3
[M+HCOO]- 249.097981 166.7
[M+CH3COO]- 263.113631 181.9
[M+Na-2H]- 225.074446 148.6
[M]+ 204.09923142 150.4
[M]- 204.10032858 150.4
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