CID 86493

3-phenoxy-2-hydroxypropyl acrylate

Structural Information

Molecular Formula
C12H14O4
SMILES
CCCOC(=O)C(=COC1=CC=CC=C1)O
InChI
InChI=1S/C12H14O4/c1-2-8-15-12(14)11(13)9-16-10-6-4-3-5-7-10/h3-7,9,13H,2,8H2,1H3
InChIKey
FOKZHJCFBNVOAV-UHFFFAOYSA-N
Compound name
propyl 2-hydroxy-3-phenoxyprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

500
Patents

222.0892 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.09648 149.7
[M+Na]+ 245.07842 160.0
[M+NH4]+ 240.12302 156.0
[M+K]+ 261.05236 155.1
[M-H]- 221.08192 149.5
[M+Na-2H]- 243.06387 154.2
[M]+ 222.08865 150.7
[M]- 222.08975 150.7
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