CID 61642

2-(2-hydroxyethoxy)ethyl acrylate

Structural Information

Molecular Formula
C7H12O4
SMILES
C=CC(=O)OCCOCCO
InChI
InChI=1S/C7H12O4/c1-2-7(9)11-6-5-10-4-3-8/h2,8H,1,3-6H2
InChIKey
RWXMAAYKJDQVTF-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethoxy)ethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8055
Patents

160.07356 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.08084 133.1
[M+Na]+ 183.06278 139.9
[M-H]- 159.06628 131.9
[M+NH4]+ 178.10738 153.2
[M+K]+ 199.03672 139.6
[M+H-H2O]+ 143.07082 128.4
[M+HCOO]- 205.07176 155.5
[M+CH3COO]- 219.08741 173.8
[M+Na-2H]- 181.04823 138.0
[M]+ 160.07301 136.6
[M]- 160.07411 136.6
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