CID 84641

2-(benzoyloxy)ethyl methacrylate

Structural Information

Molecular Formula
C13H14O4
SMILES
CC(=C)C(=O)OCCOC(=O)C1=CC=CC=C1
InChI
InChI=1S/C13H14O4/c1-10(2)12(14)16-8-9-17-13(15)11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3
InChIKey
IRUHNBOMXBGOGR-UHFFFAOYSA-N
Compound name
2-(2-methylprop-2-enoyloxy)ethyl benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

292
Patents

234.0892 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.09648 151.8
[M+Na]+ 257.07842 157.6
[M-H]- 233.08192 155.0
[M+NH4]+ 252.12302 169.2
[M+K]+ 273.05236 156.5
[M+H-H2O]+ 217.08646 145.3
[M+HCOO]- 279.08740 173.6
[M+CH3COO]- 293.10305 190.1
[M+Na-2H]- 255.06387 154.3
[M]+ 234.08865 154.8
[M]- 234.08975 154.8
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

patents stripe