CID 3017597

65343-67-1

Structural Information

Molecular Formula
C11H14O4
SMILES
CCOC(=O)C(C)OC1=CC=C(C=C1)O
InChI
InChI=1S/C11H14O4/c1-3-14-11(13)8(2)15-10-6-4-9(12)5-7-10/h4-8,12H,3H2,1-2H3
InChIKey
ILYSHPJWNMPBPE-UHFFFAOYSA-N
Compound name
ethyl 2-(4-hydroxyphenoxy)propanoate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

2
References

308
Patents

210.0892 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.09648 145.0
[M+Na]+ 233.07842 151.7
[M-H]- 209.08192 147.3
[M+NH4]+ 228.12302 163.1
[M+K]+ 249.05236 151.0
[M+H-H2O]+ 193.08646 139.0
[M+HCOO]- 255.08740 166.5
[M+CH3COO]- 269.10305 184.2
[M+Na-2H]- 231.06387 148.5
[M]+ 210.08865 147.9
[M]- 210.08975 147.9
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

No patent data available for this compound.