CID 86093

2-hydroxy-3-phenoxypropyl methacrylate

Structural Information

Molecular Formula
C13H16O4
SMILES
CC(=C)C(=O)OCC(COC1=CC=CC=C1)O
InChI
InChI=1S/C13H16O4/c1-10(2)13(15)17-9-11(14)8-16-12-6-4-3-5-7-12/h3-7,11,14H,1,8-9H2,2H3
InChIKey
HFXVXHPSVLHXCC-UHFFFAOYSA-N
Compound name
(2-hydroxy-3-phenoxypropyl) 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

1856
Patents

236.10486 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.112136 153.8
[M+Na]+ 259.094078 158.7
[M-H]- 235.097584 155.5
[M+NH4]+ 254.138683 170.4
[M+K]+ 275.068018 157.4
[M+H-H2O]+ 219.102120 147.4
[M+HCOO]- 281.103061 173.9
[M+CH3COO]- 295.118711 189.1
[M+Na-2H]- 257.079526 155.7
[M]+ 236.10431142 155.7
[M]- 236.10540858 155.7
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